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517895

Sigma-Aldrich

trans-4-Phenyl-3-buten-2-one-1,1,1,3-d4

97 atom % D

Synonym(s):

benzalacetone-d4, benzylideneacetone-d4

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About This Item

Linear Formula:
C6H5CH=CDCOCD3
CAS Number:
130208-38-7
Molecular Weight:
150.21
MDL number:
MFCD02093714
UNSPSC Code:
12352202
PubChem Substance ID:
24873983

isotopic purity

97 atom % D

bp

260-262 °C (lit.)

mp

39-42 °C (lit.)

mass shift

M+4

SMILES string

[H]\C(=C(\[2H])C(=O)C([2H])([2H])[2H])c1ccccc1

InChI

1S/C10H10O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+/i1D3,7D

InChI key

BWHOZHOGCMHOBV-UGHRQIHESA-N

Related Categories

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

signalword

Danger

Hazard Classifications

Eye Irrit. 2 - Flam. Sol. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

Storage Class

4.1B - Flammable solid hazardous materials

wgk_germany

WGK 3

flash_point_f

150.0 °F - closed cup

flash_point_c

65.56 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Certificates of Analysis (COA)

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