Registration Dossier

General information

Inventory

EC number:
213-426-9
EC name:
Hydroxycyclohexyl phenyl ketone
CAS number:
947-19-3

No inventory information available

Reference substance information

IUPAC name:
1-benzoylcyclohexan-1-ol
Synonyms
Names:
Ketone, 1-hydroxycyclohexyl phenyl
Methanone, (1-hydroxycyclohexyl)phenyl-
TK 12599
Identifier:
CAS number
947-19-3
Identifier:
EC number
213-426-9
Identifier:
IUPAC name
1-benzoylcyclohexan-1-ol
Identifier:
IUPAC name
(1-hydroxycyclohexyl)-phenylmethanone
Identifier:
IUPAC name
1-Hydroxy-cyclohexyl-phenylketone
Identifier:
IUPAC name
1-benzoylcyclohexan-1-ol
Identifier:
PubChem
70355
Identifier:
other: Molecular formula
C13H16O2
Identifier:
other: InChl
InChI=1/C13H16O2/c14-12(11-7-3-1-4-8-11)13(15)9-5-2-6-10-13/h1,3-4,7-8,15H,2,5-6,9-10H2
Identifier:
other: NSC Number
401908
Identifier:
other: SMILES notation
C1CCC(CC1)(C(=O)C2=CC=CC=C2)O
Identifier:
other: UNII
E7JVN2243X
Identifier:
other: InChl
InChI=1S/C13H16O2/c14-12(11-7-3-1-4-8-11)13(15)9-5-2-6-10-13/h1,3-4,7-8,15H,2,5-6,9-10H2
Identifier:
other: SMILES notation
O=C(c1ccccc1)C1(O)CCCCC1
(1-hydroxycyclohexyl)(phenyl)methanone

CAS information

CAS number:
947-19-3

Molecular and structural information

Molecular formula:
C13H16O2
Molecular weight:
204.265
SMILES notation:
OC1(CCCCC1)C(=O)c2ccccc2
InChl:
InChI=1/C13H16O2/c14-12(11-7-3-1-4-8-11)13(15)9-5-2-6-10-13/h1,3-4,7-8,15H,2,5-6,9-10H2
Structural formula:
Chemical structure