2- (Ethanesulfinyl) cyclohexan-1-amine

CAT: 0926-SDC27335-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-SDC27335-01Size:50 mg

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CAS Number

1342273-35-1

MDL Number

MFCD20380845

Smiles

CCS (=O) C1CCCCC1N

Molecular Formula

C8H17NOS

Molecular Weight

175.29 g/mol

Controlled

Chemical Information

2-(Ethanesulfinyl)cyclohexan-1-amine

CAS Number	1342273-35-1
PubChem CID	64651718
IUPAC Name	2-ethylsulfinylcyclohexan-1-amine
Molecular Formula	C8H17NOS
Molecular Weight	175.29
XLogP	0.5
Topological Polar Surface Area	62.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	149

SMILES

CCS(=O)C1CCCCC1N

InChI

InChI=1S/C8H17NOS/c1-2-11(10)8-6-4-3-5-7(8)9/h7-8H,2-6,9H2,1H3

InChIKey

RMUUQKVHLRUUME-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1342273-35-1

CID: 64651718

Formula: C8H17NOS

MW: 175.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	175.29
XLogP3	0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	175.10308534
Monoisotopic Mass	175.10308534
Topological Polar Surface Area	62.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	149
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
QDC20472-01	3- (Ethanesulfinyl) cyclohexan-1-amine
BHA24096-01	2- (Ethanesulfinyl) ethan-1-amine hydrochloride
XZB40630-01	2- (Cyclopentylmethyl) cyclohexan-1-amine
VAA32231-01	2- (Ethylsulfanyl) cyclohexan-1-amine
QBA01592-01	2- (Aminomethyl) cyclohexan-1-amine
FSD25242-01	2- (Dimethylphosphoryl) cyclohexan-1-amine
TEA56004-01	1- (2-Methylphenyl) cyclohexan-1-amine
FCA76207-01	2-[ (Diethylamino) methyl]cyclohexan-1-amine
DQD64018-01	2- (2-Methylpropyl) cyclohexan-1-amine hydrochloride
GCC60332-01	2- (2-Fluorophenoxy) cyclohexan-1-amine hydrochloride

Catalog	Name
409207-01	1-Bromo-3- (ethanesulfinyl) benzene
sc-333113A	1- (aminomethyl) cyclohexan-1-amine
OR85553-01	1- (Aminomethyl) cyclohexan-1-amine dihydrochloride
OR78643-01	4- (Methylsulfonyl) cyclohexan-1-amine hydrochloride
GTR19277268-01	4- (2-Aminoethyl) cyclohexan-1-amine
OR1053481-01	Trans-4- (Aminomethyl) cyclohexan-1-amine
PC111770-01	4- (Difluoromethylene) cyclohexan-1-amine hydrochloride
OR95694-01	4- (tert-Butyl) cyclohexan-1-amine
sc-345114	1- (morpholin-4-ylcarbonyl) cyclohexan-1-amine hydrochloride
OR1049038	4- (4-tert-Butylphenyl) cyclohexan-1-amine