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Benzene-D6

Benzene-D6 structure

CAS No.: 1076-43-3

Chemical Name:: Benzene-D6

Synonyms: HEXADEUTEROBENZENE;D6-Benzene;Benze;(2H6)benzene;hexadeuterio-benzene;Benzene-d6 solution;48940-u;ENZENE-D6;bemzene d6;BENZENE-D6

CBNumber:: CB3685998

Molecular Formula:: C6D6

Molecular Weight:: 84.15

MDL Number:: MFCD00003010

MOL File:: 1076-43-3.mol

MSDS File:: SDS

TDS File:: TDS

Last updated:2026-05-20 15:45:12

Product description	Number	Pack Size	Price
Benzene-d6 solution certified reference material, 2000?μg/mL in methanol	48940-U	1mL	$43.8
Benzene-d6 99.6 atom % D	151815	10x0.75ml	$68.2
Benzene-d6 99.6 atom % D	151815	10g	$82.6
Benzene-d6 99.6 atom % D	151815	10x1ml	$84.1
Benzene-D6 deuteration degree min. 99.5% for NMR spectroscopy MagniSolv?	1.01789	100mL	$689
More product size

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Benzene-D6 Properties

Melting point	6.8 °C(lit.)
Melting point	5,5°C
Boiling point	79.1 °C(lit.)
Boiling point	80,1°C
Density	0.950 g/mL at 25 °C(lit.)
Density	d = 0,95
vapor pressure	101 hPa (20 °C)
refractive index	n20/D 1.497(lit.)
Flash point	12 °F
storage temp.	no restrictions.
solubility	Miscible with most organic solvents.
form	Liquid
color	Colorless
Specific Gravity	0.950
explosive limit	1.4-8.0%(V)
Water Solubility	Slightly Soluble in water.
Sensitive	Moisture Sensitive
BRN	1905426
Henry's Law Constant	1.8×10^-3 mol/(m³Pa) at 25℃, Hiatt (2013)
Exposure limits	ACGIH: TWA 0.5 ppm; STEL 2.5 ppm (Skin) OSHA: Ceiling 25 ppm; TWA 10 ppm; TWA 1 ppm; STEL 5 ppm NIOSH: IDLH 500 ppm; TWA 0.1 ppm; STEL 1 ppm
Stability	Stable. Incompatible with oxidizing agents, acids, bases, halogens, metal salts. Protect from moisture. Highly flammable.
InChI	1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D
InChIKey	UHOVQNZJYSORNB-MZWXYZOWSA-N
SMILES	[2H]c1c([2H])c([2H])c([2H])c([2H])c1[2H]
CAS DataBase Reference	1076-43-3(CAS DataBase Reference)
EPA Substance Registry System	Benzene-d6 (1076-43-3)
UNSPSC Code	77101502
NACRES	NA.24

SAFETY

Risk and Safety Statements

Symbol(GHS)

GHS02,GHS07,GHS08

Signal word

Danger

Hazard statements

H225-H304-H315-H319-H340-H350-H372-H412

Precautionary statements

P210-P273-P301+P310-P303+P361+P353-P305+P351+P338-P331

target organs

Blood

PPE

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Hazard Codes

F,T

Risk Statements

45-46-11-36/38-48/23/24/25-65-39/23/24/25-23/24/25-48/23/24

Safety Statements

53-45-36/37

RIDADR

UN 1114 3/PG 2

WGK Germany

10-21

Autoignition Temperature

555 °C

TSCA

TSCA listed

HazardClass

PackingGroup

HS Code

29022000

Storage Class

3 - Flammable liquids

Hazard Classifications

Aquatic Chronic 3
Asp. Tox. 1
Carc. 1A
Eye Irrit. 2
Flam. Liq. 2
Muta. 1B
Skin Irrit. 2
STOT RE 1

Toxicity

LD50 orally in Rabbit: 930 mg/kg LD50 dermal Rabbit > 8260 mg/kg

Limited Quantities

1.0 L (0.3 gallon) (liquid)

Excepted Quantities

Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)

NFPA 704

	3
3		0

Benzene-D6 price More Price(52)

Manufacturer	Product number	Product description	CAS number	Packaging	Price	Updated	Buy
Sigma-Aldrich	48940-U	Benzene-d6 solution certified reference material, 2000?μg/mL in methanol	1076-43-3	1mL	$43.8	2026-04-30	Buy
Sigma-Aldrich	151815	Benzene-d6 99.6 atom % D	1076-43-3	10x0.75ml	$68.2	2026-04-30	Buy
Sigma-Aldrich	151815	Benzene-d6 99.6 atom % D	1076-43-3	10g	$82.6	2026-04-30	Buy
Sigma-Aldrich	151815	Benzene-d6 99.6 atom % D	1076-43-3	10x1ml	$84.1	2026-04-30	Buy
Sigma-Aldrich	1.01789	Benzene-D6 deuteration degree min. 99.5% for NMR spectroscopy MagniSolv?	1076-43-3	100mL	$689	2026-04-30	Buy

Product number	Packaging	Price	Buy
48940-U	1mL	$43.8	Buy
151815	10x0.75ml	$68.2	Buy
151815	10g	$82.6	Buy
151815	10x1ml	$84.1	Buy
1.01789	100mL	$689	Buy

Benzene-D6 Chemical Properties,Uses,Production

Chemical Properties

Benzene-d6 is a flammable, viscous organic solvent with the formula C6D6. It is used to dissolve a wide range of compounds and has a density of 0.87 g/cm3 (20 oC).The 1H-NMR spectrum of deuterated benzene comprises of a singlet at 7.16 ppm (vs. TMS). The 13C-NMR spectrum consists of a triplet of equal intensity at 128.39 ppm (vs. TMS). The water resonance is at 0.5 ppm. Benzene-d6 is slightly hygroscopic and thus some care should be taken to minimize contact of the solvent with atmospheric water.

Uses

Isotope labelled benzene, an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.

Uses

Benzene-d6 is a solvent used in nuclear magnetic resonance spectroscopy (NMR).

Definition

ChEBI: Benzene-d6 is a deuterated compound, a member of benzenes, an aromatic annulene and a volatile organic compound.

Application

Isotope labelled benzene, an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.

General Description

Benzene-d₆ (C₆D₆) is deuterated benzene. Its Soret coefficient S(T) has been measured by transient holographic grating technique. Its synthesis,¹³C NMR, IR and MS spectra have been reported.

Purification Methods

Hexadeuteriobenzene of 99.5% purity is refluxed over and distilled from CaH2 onto Linde type 5A sieves under N2. [Beilstein 5 III 518, 5 IV 630.]

Benzene-D6 synthesis

Synthesis of Benzene-D6 from hexafluorobenzene

Benzene-D6 Preparation Products And Raw materials

Raw materials

AZOBENZENE-D10 NAPHTHALENE-D8 HEXABROMOBENZENE TOLUENE-D8

Preparation Products

6-METHYL-2-(METHYLSULFANYL)PYRIMIDIN-4-YLAMINE phenyl-D5-boronic acid BENZYL-D7 ALCOHOL BENZOIC ACID-D5 ANILINE D5

Chlorofluoromethane

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Benzene-D6 Suppliers

Global( 286)Suppliers

Supplier	Tel	Email	Country	ProdList	Advantage
Yurui (Shanghai) Chemical Co., Ltd.	+86-021-50456736 +8613761615711	yuki@riyngroup.com	China	1028	58
SHANGHAI KEAN TECHNOLOGY CO., LTD.	+8613817748580	cooperation@kean-chem.com	China	40066	58
Yurui(Shanghai) Chemical Co. Ltd	+86-02150456736 +86-17613296318	xin@riyngroup.com	China	288	58
Shaanxi Dideu Medichem Co. Ltd	+8617392709771	1097@dideu.com	China	3995	58
Shanghai UCHEM Inc.	+862156762820 +86-13564624040	sales@myuchem.com	China	8671	58
Henan Fengda Chemical Co., Ltd	+86-371-86557731 +86-13613820652	info@fdachem.com	China	20124	58
Springchem New Material Technology Co.,Limited	+86-021-62885108 +8613917661608	info@spring-chem.com	China	2068	57
career henan chemical co	+86-0371-86658258 +8613203830695	sales@coreychem.com	China	29816	58
CONIER CHEM AND PHARMA LIMITED	+8618523575427	sales@conier.com	China	49977	58
Richest Group Ltd	18017061086	oled@richest-group.com	CHINA	5600	58

Supplier	Advantage
Yurui (Shanghai) Chemical Co., Ltd.	58
SHANGHAI KEAN TECHNOLOGY CO., LTD.	58
Yurui(Shanghai) Chemical Co. Ltd	58
Shaanxi Dideu Medichem Co. Ltd	58
Shanghai UCHEM Inc.	58
Henan Fengda Chemical Co., Ltd	58
Springchem New Material Technology Co.,Limited	57
career henan chemical co	58
CONIER CHEM AND PHARMA LIMITED	58
Richest Group Ltd	58

View Lastest Price from Benzene-D6 manufacturers

Update time	Product	Price	Min. Order	Purity	Supply Ability	Manufacturer
2026-05-20	Benzene-d6 1076-43-3	US $38.00-378.00 / g	5g	0.99	25kg	Shanghai UCHEM Inc.
2026-04-20	Benzene-D6 1076-43-3	US $0.00-0.00 / mg			10g	TargetMol Chemicals Inc.
2026-01-20	Benzene-D6 1076-43-3	US $0.00-0.00 / kg	1kg	99%+	1kg 5kg 10kg 50kg 100kg 1000kg	Yurui(Shanghai) Chemical Co. Ltd

Benzene-d6
1076-43-3
US $38.00-378.00 / g
0.99
Shanghai UCHEM Inc.

Benzene-D6
1076-43-3
US $0.00-0.00 / mg
TargetMol Chemicals Inc.

Benzene-D6
1076-43-3
US $0.00-0.00 / kg
99%+
Yurui(Shanghai) Chemical Co. Ltd

Benzene-D6 Spectrum

BENZENE-D6(1076-43-3)MS BENZENE-D6(1076-43-3)¹HNMR BENZENE-D6(1076-43-3)¹³CNMR BENZENE-D6(1076-43-3)IR1 BENZENE-D6(1076-43-3)Raman

1076-43-3(Benzene-D6 )Related Search:

Benzene-D6 1,2-BIS(CHLOROMETHYL)BENZENE (+)-1,2-BIS[(2S,5S)-2,5-DIETHYLPHOSPHOLANO]BENZENE (-)-1,2-BIS((2S,5S)-2,5-DIISOPROPYLPHOSPHOLANO)BENZENE,(-)-1,2-BIS((2S,5S)-2,5-DI-I-PROPYLPHOSPHOLANO)BENZENE (-)-1,2-BIS((2R,5R)-DIMETHYLPHOSPHOLANO)BENZENE(CYCLOOCTADIENE)RHODIUM(I) BF4

1,2-BIS(DIBROMOMETHYL)BENZENE ACETOPHENONE-D8 1,2-BIS(DI-TERT-BUTYLPHOSPHINOMETHYL)BENZENE 1,2-BIS(CYANOMETHYL)BENZENE 1,2-BIS(DIPHENYLPHOSPHINOMETHYL)BENZENE

1,2-BIS-DECYLOXY-BENZENE BENZO[A]PYRENE-D12 1,2-BIS(HYDROXYMETHYL)BENZENE 1,2-BIS(METHANESULFONAMIDO)BENZENE (+)-1,2-BIS[(2S,5S)-2,5-DIMETHYLPHOSPHOLANO]BENZENE

(+)-1,2-BIS((2S,5S)-2,5-DIETHYLPHOSPHOLANO)BENZENE(CYCLOOCTADIENE)RHODIUM (I) TRIFLUOROMETHANESULFONATE (1,1,2,2-TETRAFLUOROETHOXY)BENZENE Thiophanate-methyl

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(2H6)benzene hexadeuterio-benzene Hexadeuterobenzol Perdeuteratedbenzene Perdeuterobenzene Benzene-d6, with 0.03% TMS, 99.6 atom% D BenzeneD6>99.6%(+0.03%tms) BenzeneD6>99.96%10x0.75ml BenzeneD6>99.96% BenzeneD6>99.6%10x0.75ml BenzeneD6>99.6% BenzeneD6>99.96%2x0.75ml BenzeneD6>99.6%10x1ml Benzene-D6 "100%" 48940-u bemzene d6 BENZENE-D6, ISOTOPIC PURITY 99.5+% Benzene-D6 "100%" >99.95 Atom % D Benzene-D6 >99.50 Atom % D Benzene-D6 >99.50 Atom % D 0.03%TMS Benzene-d6, 99.5%(Isotopic) Benzene-d6, 100%(Isotopic), contains 0.03% v/v TMS Benzene-d6, 100%(Isotopic) HEXADEUTEROBENZENE BENZENE (12C6; D6) BENZENE-D6 Benzene-d6 solution Benzene-d6,for NMR,packaged in 0.75 ml ampules, 99.6 atom % D Benzene-d6,for NMR,packaged in 0.75 ml ampules, 100.0 atom% D Benzene-d6,for NMR,packaged in 0.50 ml ampules, 100.0 atom % D Benzene-d₆, 99.5% (Isotopic) Benzene-d₆, 100% (Isotopic) Benzene-d₆, 100% (Isotopic), contains 0.03% v/v TMS Benzene-d6, deuteration degree min. 99,5%, NMR spectroscopy grade, Spectrosol Benzene-d6, deuteration degree min. 99,8%, NMR spectroscopy grade, Spectrosol Benzene-d6 99.6atom%D (0.75ml*10) Benzene-d6 1g [1076-43-3] Benzene-d6,Hexadeuterobenzene, Benzene-d6, 100% Isotopic, contains 0.03% TMS Benzene-1,2,3,4,5,6-d6 1,2,3,4,5,6-hexadeuteriobenzene Benzene-d6, 99.96 atom%D Benzene-d_6, Isotopic 1,2,3,4,5,6-hexadeuterobenzene BENZENE-D7 Benzenedisotopicpurity BENZENE-D6, 99.6 ATOM % D (SCREW-CAP BOT TLE) BENZENE-D6, 99.5 ATOM % D (CONTAINS 1% V /V TMS) BENZENE-D6, 1000MG, NEAT BENZENE 99.5 ATOM % D BENZENE-D6, 99.5 ATOM % D BENZENE-D6, 99.6 ATOM % D, ANHYDROUS & BENZENE-D6, 99.6 ATOM % D (0.03% V/V TMS ) BENZENE-D6, 99.6 ATOM % D (1PK=10 X 0.75 ML) BENZENE-D6, 99.6 ATOM % D (CONTAINS 0.1% V/V TMS) BENZENE-D6 99.5 ATOM % DCONTAINS 1% TMS BENZENE-D6, 99.6 ATOM % D & BENZENE-D6 99 ATOM % D