ChemicalBook--->CAS DataBase List--->102-79-4

102-79-4

102-79-4 Structure

102-79-4 Structure
IdentificationMore
[Name]

2,2'-(Butylimino)diethanol
[CAS]

102-79-4
[Synonyms]

2,2'-(BUTYLIMINO)DIETHANOL
2,2'-(N-BUTYLIMINO)DIETHANOL
BUTYL DIETHANOLAMINE
N-BUTYL-2,2'-IMINODIETHANOL
N-BUTYLBIS(2-HYDROXYETHYL)-AMINE
N-BUTYLDIETHANOLAMINE
N,N-BIS(2-HYDROXYETHYL)BUTYLAMINE
N-N-BUTYL-2,2'-IMINODIETHANOL
N-N-BUTYLDIETHANOLAMINE
TIMTEC-BB SBB008846
2-(N-Butyl-N-2-hydroxyethylamino)ethanol
2,2’-(butylimino)bis-ethano
2,2’-(butylimino)bisethanol
2,2’-(butylimino)bis-Ethanol
2,2’-(butylimino)di-ethano
BIDE
Bis(beta-hydroxyethyl)butylamine
butyl-bis-(2-hydroxy-ethyl)-amine
Butylbis(2-hydroxyethyl)amine
Ethanol, 2,2'-(butylimino)di-
[EINECS(EC#)]

203-055-0
[Molecular Formula]

C8H19NO2
[MDL Number]

MFCD00002856
[Molecular Weight]

161.24
[MOL File]

102-79-4.mol
Chemical PropertiesBack Directory
[Appearance]

colourless to light yellow liquid
[Melting point ]

-70 °C (lit.)
[Boiling point ]

273-275 °C/741 mmHg (lit.)
[density ]

0.986 g/mL at 25 °C(lit.)
[vapor density ]

5.5 (vs air)
[vapor pressure ]

1 mm Hg ( 25 °C)
[refractive index ]

n20/D 1.463(lit.)
[Fp ]

260 °F
[storage temp. ]

Store below +30°C.
[form ]

Powder
[pka]

14.41±0.10(Predicted)
[color ]

Red-brown to dark brown
[Specific Gravity]

0.970 (20/4℃)
[PH]

10.8-11.1 (100g/l, H2O, 20℃)
[Stability:]

Stable. Combustible. Incompatible with strong oxidizing agents.
[explosive limit]

1.1-6.5%(V)
[Water Solubility ]

miscible
[Sensitive ]

Hygroscopic
[BRN ]

1739642
[Cosmetics Ingredients Functions]

BUFFERING
[InChI]

1S/C8H19NO2/c1-2-3-4-9(5-7-10)6-8-11/h10-11H,2-8H2,1H3
[InChIKey]

GVNHOISKXMSMPX-UHFFFAOYSA-N
[SMILES]

CCCCN(CCO)CCO
[LogP]

0.58 at 25℃
[CAS DataBase Reference]

102-79-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethanol, 2,2'-(butylimino)bis-(102-79-4)
[EPA Substance Registry System]

102-79-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R37:Irritating to the respiratory system.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 2735 8/PG 2
[WGK Germany ]

1
[RTECS ]

KK0525000
[Autoignition Temperature]

260 °C
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29221980
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Dam. 1
[Safety Profile]

Mddly toxic via ingestion. A skin and severe eye irritant. Combustible when exposed to heat or flame. To fight fire, use alcohol foam, foam, CO2, dry chemical. Incompatible with oxidizing materials. When heated to decomposition it emits toxic fumes of NOx. See also AMINES.
[Toxicity]

LD50 orally in Rabbit: 4800 mg/kg
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,2'-(Butylimino)diethanol(102-79-4).msds
Hazard InformationBack Directory
[Chemical Properties]

colourless to light yellow liquid
[Uses]

N-Butyldiethanolamine (H2bdea, N-n-butyldiethanolamine) has been used in the synthesis of the following complexes (Hdnba = 3,5-dinitrobenzoic acid, Hpta = p-toluic acid, H2tpa = terephthalic acid):
  • new mononuclear [Cu(Hbdea)2]·2Hdnba , dinuclear [Cu2(μ-Hbdea)2(N3)2] and [Cu2(μ-Hbdea)2(pta)2]·2H2O
  • 1D polymeric [Cu2(μ-Hbdea)2(μ-tpa)]n·2nH2O copper(II) compounds
  • tetranuclear 3d-4f single-molecule magnet (SMM) complexes
[General Description]

N-Butyldiethanolamine (N-n-butyldiethanolamine) is a tertiary amine. It acts as an N-substituted diethanolamine ligand. It reacts with chromium(II) and lanthanide(III)/rare earth salts (Ln = La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm, Yb, Lu, Y) in the presence of coligands to afford three series of isostructural 1:1 3d(Cr(III))/4f(Ln(III)) coordination cluster compounds.
[Flammability and Explosibility]

Nonflammable
[Toxics Screening Level]

The initial threshold screening level (ITSL) for Butyldiethanolamine is 14 μg/m3 annual avg based on this LD-50 using the equation in R232(1)(h).
Spectrum DetailBack Directory
[Spectrum Detail]

2,2'-(Butylimino)diethanol(102-79-4)MS
2,2'-(Butylimino)diethanol(102-79-4)1HNMR
2,2'-(Butylimino)diethanol(102-79-4)13CNMR
2,2'-(Butylimino)diethanol(102-79-4)IR1
2,2'-(Butylimino)diethanol(102-79-4)IR2
2,2'-(Butylimino)diethanol(102-79-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

N-N-Butyldiethanolamine, 98%(102-79-4)
[Alfa Aesar]

N-n-Butyldiethanolamine, 98%(102-79-4)
[Sigma Aldrich]

102-79-4(sigmaaldrich)
[TCI AMERICA]

N-Butyldiethanolamine,>98.0%(GC)(102-79-4)
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