Hexylamine

CAT: 0024-sc-250112Size: 5 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-250112Size:5 mL

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CAS Number

111-26-2

Chemical Information

Hexylamine

1-hexanamine is a 6-carbon primary aliphatic amine. It has a role as a metabolite. It is a conjugate base of a hexan-1-aminium.

CAS Number	111-26-2
PubChem CID	8102
IUPAC Name	hexan-1-amine
Molecular Formula	C6H15N
Molecular Weight	101.19
XLogP	2.1
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	7
Formal Charge	0
Complexity	27

SMILES

CCCCCCN

InChI

InChI=1S/C6H15N/c1-2-3-4-5-6-7/h2-7H2,1H3

InChIKey

BMVXCPBXGZKUPN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 111-26-2

CID: 8102

Formula: C6H15N

MW: 101.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	101.19
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	101.120449483
Monoisotopic Mass	101.120449483
Topological Polar Surface Area	26 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	27.4
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
sc-283589A	3- (Hexylamino) propionitrile
sc-283589	3- (Hexylamino) propionitrile
sc-489486	Hexylcaine Hydrochloride
sc-340305A	2- (hexylamino) ethan-1-ol
sc-340305	2- (hexylamino) ethan-1-ol
sc-482092	4-Methyl-2-hexanamine HCl
sc-329647	N- (3-Methoxypropyl) -1-hexanamine
sc-275933	3-[6- (2-Cyano-ethylamino) -hexylamino]-propionitrile
sc-205155	6-[4- (1H-imidazol-1-yl) phenoxy]-N, N-dimethyl-1-hexanamine, dihydrochloride
sc-205155A	6-[4- (1H-imidazol-1-yl) phenoxy]-N, N-dimethyl-1-hexanamine, dihydrochloride