4- (4-Methylphenyl) cyclohexan-1-amines

CAT: 0926-TEC79572-02Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-TEC79572-02Size:0.5 g

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CAS Number

1368795-72-5

MDL Number

MFCD21881338

Smiles

CC1=CC=C (C=C1) C2CCC (CC2) N

Molecular Formula

C13H19N

Molecular Weight

189.3 g/mol

Controlled

Chemical Information

4-(4-Methylphenyl)cyclohexan-1-amine

CAS Number	1368795-72-5
PubChem CID	21534647
IUPAC Name	4-(4-methylphenyl)cyclohexan-1-amine
Molecular Formula	C13H19N
Molecular Weight	189.30
XLogP	2.7
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	162

SMILES

CC1=CC=C(C=C1)C2CCC(CC2)N

InChI

InChI=1S/C13H19N/c1-10-2-4-11(5-3-10)12-6-8-13(14)9-7-12/h2-5,12-13H,6-9,14H2,1H3

InChIKey

RYQPVSXRIFAFNB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1368795-72-5

CID: 21534647

Formula: C13H19N

MW: 189.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	189.30
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	189.151749610
Monoisotopic Mass	189.151749610
Topological Polar Surface Area	26 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	162
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
MKD92988-01	4-Methyl-4- (morpholin-4-yl) cyclohexan-1-amines
MRD33482-01	3- (Dimethylphosphoryl) cyclohexan-1-amines
JBD30898-01	1- (2-Bromo-4-methylphenyl) cyclohexan-1-amine hydrochloride
JBD30653-01	1- (4-Bromo-3-methylphenyl) cyclohexan-1-amine hydrochloride
TEA56004-01	1- (2-Methylphenyl) cyclohexan-1-amine
PAA37090-01	4- (4-Methylpentyl) cyclohexan-1-one
CYB89080-01	4- (4-Chlorophenyl) cyclohexan-1-amine
PCC92841-01	4- (Methoxymethyl) cyclohexan-1-amine
EAA34250-01	4-Propoxycyclohexan-1-amines
SAA38080-01	1- (4-Fluorophenyl) cyclohexan-1-amine

Catalog	Name
OR5044-01	Cyclohexan-1,4-dione
RG-E140393-01	4- (methylamino) cyclohexan-1-one
OR18843-01	4- (Benzyloxy) cyclohexan-1-one
sc-261541A	4- (Trifluoromethyl) cyclohexan-1-one
PC110234-01	4- (Difluoromethyl) cyclohexan-1-one
OR1005888	4- (Methylsulfonyl) cyclohexan-1-one
sc-261540	4- (Trifluoromethyl) cyclohexan-1-ol
PC1006330-01	4- (Trifluoromethoxy) cyclohexan-1-one
OR1035317-01	4- (Benzyloxy) cyclohexan-1-ol
OR49023-01	4- (Dimethylamino) cyclohexan-1-one