1-Cyclopentylethane-1,2-diamine

CAT: 0926-PTB35893-02Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-PTB35893-02Size:0.5 g

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CAS Number

1089358-93-9

MDL Number

MFCD11503939

Smiles

C1CCC (C1) C (CN) N

Molecular Formula

C7H16N2

Molecular Weight

128.22 g/mol

Controlled

Chemical Information

1-Cyclopentylethane-1,2-diamine

CAS Number	1089358-93-9
PubChem CID	22315742
IUPAC Name	1-cyclopentylethane-1,2-diamine
Molecular Formula	C7H16N2
Molecular Weight	128.22
XLogP	0.2
Topological Polar Surface Area	52
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	9
Formal Charge	0
Complexity	77

SMILES

C1CCC(C1)C(CN)N

InChI

InChI=1S/C7H16N2/c8-5-7(9)6-3-1-2-4-6/h6-7H,1-5,8-9H2

InChIKey

XTMAWRIDJLIMJT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1089358-93-9

CID: 22315742

Formula: C7H16N2

MW: 128.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.22
XLogP3	0.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	128.131348519
Monoisotopic Mass	128.131348519
Topological Polar Surface Area	52 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	77
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
SAA85473-01	2-Cyclopentylethane-1-sulfonamide
SCA13014-01	Tetramethylbenzene-1,2-diamine
CCA94041-01	Pentane-1,2-diamine
FAA70056-01	1-Phenylethane-1,2-diamine
WDA92949-01	1- (2-Methoxyphenyl) ethane-1,2-diamine
FCA89942-01	1-N-Propylbenzene-1,2-diamine
VWC49282-01	1-Cyclobutylethane-1,2-diamine dihydrochloride
AZA72569-01	1-N-Cyclopentylbenzene-1,2-Diamine
RAA63594-01	1-Phenylethane-1,2-diamine dihydrochloride
TEA48203-01	1-N-Cyclopropylbenzene-1,2-diamine

Catalog	Name
OR1065721-01	1-Phenylethane-1,2-diamine
OR80492-01	1,1'-Binaphthyl-2,2'-diamine
B2310	1,1-Binaphthyl-2,2-Diamine
OR91004-01	1,2-Diphenylethane-1,2-diamine
JH807719	Naphthalene-1,2-diamine
RG-C250345-01	Cyclopentane-1,2-Diamine
OR322075-01	Benzene-1,2-diamine
PC9509	Tetrafluorobenzene-1,2-diamine
OR85634-01	Benzimidazole-1,2-diamine
OR30693	2-Methylpropane-1,2-diamine