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Merck
CN

517895

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:
Molecular Weight:
150.21
UNSPSC Code:
12352202
PubChem Substance ID:
MDL number:
Isotopic purity:
97 atom % D
Mass shift:
M+4


isotopic purity

97 atom % D

Quality Segment

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

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.



Signal Word

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

WGK 3

Flash Point (°F)

150.0 °F - closed cup

Flash Point (°C)

65.56 °C - closed cup

PPE (personal protective equipment)

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



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