3,5,5-TRIMETHYL-2-CYCLOHEXEN-1-ONE-2,4,4,6,6-D5

CAS No.
1262769-87-8
CCD No.
CCD04333523
Formula
C9 H9 D5 O
MolWeight
143.239

Basic Information

Product Name: 3,5,5-TRIMETHYL-2-CYCLOHEXEN-1-ONE-2,4,4,6,6-D5
CAS: 1262769-87-8
English Synonyms: 3,5,5-TRIMETHYL-2-CYCLOHEXEN-1-ONE-2,4,4,6,6-D5 ; ISOPHORONE-2,4,4,6,6-D5
MDL Number.: MFCD18632583
H bond acceptor: 1
H bond donor: 0
Smile: [2H]C1=C(C(C(C(C1=O)([2H])[2H])(C)C)([2H])[2H])C
InChiKey: InChIKey=null

Property

Melting Point: -8 DEG C(LIT)
Boiling Point: 213-214 DEG C(LIT)
Density: DENSITY: 0.956 G/ML AT 25 DEG C
Physical Property: FLASHPOINT: 204.8 DEG F
FLASHPOINT: 96 DEG C
Comments: ASSAY METHOD: CP
MASS SHIFT: M+5
STORAGE TEMPERATURE: -20 DEG C
WGK: 3
Information: ISOTOPIC PURITY: 97 ATOM% D
MW: 143.09 BY ATOM% CALCULATION

Safety information

Symbol: GHS07 GHS07 GHS08 GHS08
Signal word: Warning
Hazard statements: H302 + H312-H319-H335-H351
Precautionary statements: P261-P280-P305 + P351 + P338
hazard symbol: Xn
Risk Code: R:21/22-36/37-40
Safe Code: S:13-23-36/37/39-46
WGK Germany: 3

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