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1563-79-7

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1563-79-7 Structure

1563-79-7 Structure
IdentificationBack Directory
[Name]

ACETIC-1-13C ACID
[CAS]

1563-79-7
[Synonyms]

D4, 98%)
ACETIC-1-13C ACID
ACETIC ACID (1-13C)
(1-13C)Ethanoic acid
Acetic acid-1-13C
ACETIC-1-13C ACID, 99 ATOM % 13C
(1-13C)Acetic acid 99 atom % 13C
[Molecular Formula]

C2H4O2
[MDL Number]

MFCD00037366
[MOL File]

1563-79-7.mol
[Molecular Weight]

61.06
Chemical PropertiesBack Directory
[Melting point ]

16.2 °C(lit.)
[Boiling point ]

117-118 °C(lit.)
[density ]

1.066 g/mL at 25 °C
[refractive index ]

n20/D 1.372(lit.)
[Fp ]

104 °F
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Colourless Liquid
[BRN ]

1699486
[InChI]

1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/i2+1
[InChIKey]

QTBSBXVTEAMEQO-VQEHIDDOSA-N
[SMILES]

C[13C](O)=O
[CAS Number Unlabeled]

64-19-7
Safety DataBack Directory
[Hazard Codes ]

C
[Risk Statements ]

10-35
[Safety Statements ]

23-26-45
[RIDADR ]

UN 2789 8/PG 2
[WGK Germany ]

1
[RTECS ]

AF1225000
[F ]

3-10
[HS Code ]

2845909090
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Dam. 1
Flam. Liq. 3
Skin Corr. 1A
Hazard InformationBack Directory
[Uses]

Acetic acid-1-13C is 13C labeled Acetic acid-1.
[References]

[1] Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. DOI:10.1177/1060028018797110
Spectrum DetailBack Directory
[Spectrum Detail]

ACETIC-1-13C ACID(1563-79-7)1HNMR
ACETIC-1-13C ACID(1563-79-7)IR
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