4-Phenylcyclohexanone oxime

HCID 343882CAS 4500-20-3
Substructure searchFind similar structures

Basic information

Standard SMILES
ON=C1CCC(c2ccccc2)CC1
InChIKey
JTLAHVRPWDIEMU-SEYXRHQNSA-N
Molecular formula
C12H15NO
Average molar mass
189.25 g/mol

Names & identifiers

Preferred name
4-Phenylcyclohexanone oxime
IUPAC
N-(4-phenylcyclohexylidene)hydroxylamine
English name
4-Phenylcyclohexane-1-oneoxime
Molecular formula
C12H15NO
Molecular weight
189.25

Names & synonyms

4-Phenylcyclohexanone oxime4500-20-3N-(4-phenylcyclohexylidene)hydroxylamine4-Phenylcyclohexane-1-oneoximeCYCLOHEXANONE, 4-PHENYL-, OXIMEMFCD00456899NSC4004524-PhenylcyclohexanoneoximeNSC 4004524-phenylcylohexanone oxime4Phenylcyclohexanone OximeSCHEMBL257216
Show more names
4-phenyl-1-cyclohexanone oxime4-phenylcyclohexan-1-one oximeCHEMBL1996910JTLAHVRPWDIEMU-UHFFFAOYSA-NALBB-0164691-(hydroxyimino)-4-phenylcyclohexaneAKOS008939852AB06054

Database identifiers

CAS
4500-20-3
PubChem CID
343882
ChEMBL
CHEMBL1996910
Nikkaji
J80.848B

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
32.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
14

Physicochemical properties

Boiling point
125 · 125-135 °C
Density
1.1 · 1.10±0.1 g/cm3(Predicted)
pka
12.32 · 12.32±0.40(Predicted)
HazardClass
IRRITANT

Safety & regulation

Safety data

hazard_class
IRRITANT

Chemistry & industry

Suppliers15 total

郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]

Related reactions

19 records
New reaction record

Linked notes

Loading…