1-Cyclohexylbut-1-en-3-one

HCID 95597
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Basic information

CAS
7152-32-1
Standard SMILES
CC(=O)C=CC1CCCCC1
InChIKey
PZJXLLHDHUDWFH-UHFFFAOYSA-N
Molecular formula
C10H16O
Average molar mass
152.23 g/mol
Monoisotopic mass
152.12011513

Names & identifiers

Preferred name
1-Cyclohexylbut-1-en-3-one
IUPAC
4-cyclohexylbut-3-en-2-one
English name
4-cyclohexyl-3-buten-2-one
Molecular formula
C10H16O
Molecular weight
152.23344

Names & synonyms

1-cyclohexylbut-1-en-3-oneSCHEMBL814591PZJXLLHDHUDWFH-UHFFFAOYSA-NAKOS017414290NS000372384-cyclohexyl-3-buten-2-one1-Cyclohexyl-1-butene-3-one3-Buten-2-one, 4-cyclohexyl-(Z)-4-cyclohexylbut-3-en-2-one(E)-4-cyclohexylbut-3-en-2-one

Database identifiers

CAS
7152-32-1
PubChem CID
95597
DTXSID
DTXSID7064578

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

FDA UNII
82 ZQ3CVK · PM82ZQ3CVK
EPA Substance Registry System
3 · 3-Buten-2-one, 4-cyclohexyl- (7152-32-1)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H315-H319
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H315-H319
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Chemistry & industry

Suppliers3 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
南京汉海征程医药科技有限公司15850673134 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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