1-Cyclohexylprop-2-yn-1-amine

CAT: 0926-HYB50276-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-HYB50276-01Size:50 mg

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CAS Number

1207502-76-8

MDL Number

MFCD21263286

Smiles

C#CC (C1CCCCC1) N

Molecular Formula

C9H15N

Molecular Weight

137.22 g/mol

Controlled

Chemical Information

1-Cyclohexylprop-2-yn-1-amine

CAS Number	1207502-76-8
PubChem CID	65573985
IUPAC Name	1-cyclohexylprop-2-yn-1-amine
Molecular Formula	C9H15N
Molecular Weight	137.22
XLogP	1.8
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	136

SMILES

C#CC(C1CCCCC1)N

InChI

InChI=1S/C9H15N/c1-2-9(10)8-6-4-3-5-7-8/h1,8-9H,3-7,10H2

InChIKey

XIEIQEFDSYPLQZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1207502-76-8

CID: 65573985

Formula: C9H15N

MW: 137.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.22
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	137.120449483
Monoisotopic Mass	137.120449483
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	136
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
SBA13454-01	3-Cyclohexylprop-2-yn-1-ol
DCA14609-01	(But-2-yn-1-yl) (prop-2-yn-1-yl) amine hydrochloride
HGA02235-01	1-Phenylprop-2-yn-1-amine hydrochloride
RPD05320-01	1-Cyclopropylprop-2-yn-1-amine hydrochloride
ZEA74414-01	4,4-Diethoxybut-2-yn-1-amine
YZB40406-01	(But-3-yn-1-yl) (2-methoxyethyl) amine
RPD14478-01	1-Cyclobutylbut-3-yn-2-amine hydrochloride
KPC97044-01	3-Cyclopropylprop-2-yn-1-amine hydrochloride
DXC59313-01	1-Phenylpent-4-yn-2-amine hydrochloride
RPD13985-01	1-Cyclopropylbut-3-yn-2-amine hydrochloride

Catalog	Name
OR1004828-01	1-Cyclohexylprop-2-yn-1-ol
OR1049303-01	But-2-yn-1-amine
OR78173-01	1-Phenylprop-2-yn-1-amine
OR72152-01	But-3-yn-1-amine
OR1049755-01	1-Phenylprop-2-yn-1-amine hydrochloride
RG-E140978-01	N-benzylprop-2-yn-1-amine
HY-W096108	2- (but-3-yn-1-yloxy) ethan-1-amine
OR1051962-01	N- (1-Phenylethyl) prop-2-yn-1-amine
TRC-P400500-100MG	1-Phenylpent-1-yn-3-amine
OR1044063-01	Pent-4-yn-1-amine