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151777

Sigma-Aldrich

Acetic acid-d

99 atom % D

Synonym(s):

mono-Deuteroacetic acid, Acetic (acid-d), Monodeuteroacetic acid

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About This Item

Linear Formula:
CH3COOD
CAS Number:
758-12-3
Molecular Weight:
61.06
Beilstein:
1739249
EC Number:
212-059-1
MDL number:
MFCD00051050
UNSPSC Code:
12142201
PubChem Substance ID:
24849163
NACRES:
NA.21

vapor density

2.07 (vs air)

vapor pressure

11.4 mmHg

isotopic purity

99 atom % D

Assay

99% (CP)

form

liquid

expl. lim.

4-19.9 % (lit.)

technique(s)

NMR: suitable

impurities

≤0.50% water
water

bp

116-117 °C (lit.)

mp

15-16 °C (lit.)

density

1.059 g/cm3 at 25 °C

mass shift

M+1

SMILES string

[2H]OC(C)=O

InChI

1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/i/hD

InChI key

QTBSBXVTEAMEQO-DYCDLGHISA-N

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General description

Acetic acid-d (Monodeuteroacetic acid) is the monodeuterated form of acetic acid, in which the hydrogen atom of hydroxyl group has been replaced by deuterium (D). Infrared spectral studies of its vapors at 150°C in the range of 2-25μ have been reported.

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Pictograms

FlameCorrosion
GHS02,GHS05

Signal Word

Danger

Hazard Statements

H226,H314

Hazard Classifications

Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1A

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

104.0 °F - closed cup

Flash Point(C)

40 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 4: Flammable liquids
Type 2 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

151777-50G:
151777-VAR:
151777-BULK:
151777-250G:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCN3773
MKCL2443
MKCH5076
MKCF5554
MKCB9680

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