4- (Dimethylamino) -4-phenylcyclohexan-1-one

CAT: 0127-OR933659Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

65619-20-7

MDL Number

MFCD28502352

Purity

=95%

Smiles

CN(C)C1(CCC(=O)CC1)c2ccccc2

Chemical Information

4-(Dimethylamino)-4-phenylcyclohexan-1-one

CAS Number	65619-20-7
PubChem CID	11424492
IUPAC Name	4-(dimethylamino)-4-phenylcyclohexan-1-one
Molecular Formula	C14H19NO
Molecular Weight	217.31
XLogP	1.8
Topological Polar Surface Area	20.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	243

SMILES

CN(C)C1(CCC(=O)CC1)C2=CC=CC=C2

InChI

InChI=1S/C14H19NO/c1-15(2)14(10-8-13(16)9-11-14)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3

InChIKey

DEOPEYZZVGZQFC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 65619-20-7

CID: 11424492

Formula: C14H19NO

MW: 217.31

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	217.31
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	217.146664230
Monoisotopic Mass	217.146664230
Topological Polar Surface Area	20.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	243
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR5040-01	4-Phenylcyclohexan-1-one
OR310320-01	4- (Hydroxymethyl) -4-phenylcyclohexan-1-one
OR340127	2- (3-Chloro-4-nitrophenyl) -4-phenylcyclohexan-1-one
OR1005281	Cis-4-Phenylcyclohexan-1-ol
OR49023-01	4- (Dimethylamino) cyclohexan-1-one
OR1035629-01	1- (4- (Dimethylamino) phenyl) propan-1-one
OR111329	1- (Dimethylamino) -4,4-dimethylpent-1-en-3-one
OR1038114-01	4- (Dimethylamino) butan-2-one
OR1081186-01	1- (4- (dimethylamino) -3-methylphenyl) propan-1-one
OR33327-01	1- (Dimethylamino) -4-phenoxypent-1-en-3-one

Catalog	Name
FD161471-01	4- (Dimethylamino) -4-phenylcyclohexan-1-one
RID10060-01	4- (Dimethylamino) -4-methylcyclohexan-1-one
DAA76063-01	4- (Dimethylamino) -1-phenylbutan-1-one
VPA88530-01	1-[4- (Dimethylamino) phenyl]piperidin-4-one
DAA76866-01	1- (4-Bromophenyl) -4- (dimethylamino) butan-1-one
QCA61871-01	4- (4-Chlorophenyl) -4- (dimethylamino) cyclohexan-1-one
BBA67258-01	1- (4- (Dimethylamino) phenyl) propan-1-one
NJB51454	4- (dimethylamino) -4- (3-fluorophenyl) cyclohexan-1-one
QCA61953-01	4- (3-Chlorophenyl) -4- (dimethylamino) cyclohexan-1-one
DCA40042-01	1- (Dimethylamino) -4,4-dimethylpentan-3-one hydrochloride