Pentan-1-Amine Acetate

CAT: 0127-OR1076738-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1076738-01Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

64370-74-7

Purity

98%

Smiles

OCCOCCN (CC) C

Chemical Information

1-Pentanamine, acetate

CAS Number	64370-74-7
PubChem CID	22765186
IUPAC Name	acetic acid;pentan-1-amine
Molecular Formula	C7H17NO2
Molecular Weight	147.22
Topological Polar Surface Area	63.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	10
Formal Charge	0
Complexity	50

SMILES

CCCCCN.CC(=O)O

InChI

InChI=1S/C5H13N.C2H4O2/c1-2-3-4-5-6;1-2(3)4/h2-6H2,1H3;1H3,(H,3,4)

InChIKey

CZDSWGSBWBDBQV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 64370-74-7

CID: 22765186

Formula: C7H17NO2

MW: 147.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	147.22
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	147.125928785
Monoisotopic Mass	147.125928785
Topological Polar Surface Area	63.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	50.9
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	2
Compound Is Canonicalized	Yes

Catalog	Name
OR1030348	Pentan-1-Amine Hydrochloride
OR97108	Pentan-2-yl acetate
PC1003093-01	5- (4-Fluorophenyl) pentan-1-amine
OR77285-01	1- (4-Chlorophenyl) pentan-1-amine hydrochloride
PC101423-01	1- (3-Fluorophenyl) pentan-1-amine hydrochloride
OR86492-01	1- (3-Methoxyphenyl) pentan-1-amine hydrochloride
OR86491-01	1- (4-Ethoxyphenyl) pentan-1-amine hydrochloride
OR1047242-01	N-Benzylbicyclo[1.1.1]pentan-1-amine
OR312073-01	Bicyclo[1.1.1]pentan-1-amine hydrochloride
OR312417	3-Morpholinobicyclo[1.1.1]pentan-1-amine

Catalog	Name
JH914970	Methyl 2-{3-aminobicyclo[1.1.1]pentan-1-yl}acetate hydrochloride
HY-W259813	Methyl 2- (3- (2-hydroxyethyl) bicyclo[1.1.1]pentan-1-yl) acetate
UYB08673-01	Tert-Butyl 2-[ (pentan-3-ylidene) amino]acetate
UGD71303-01	2-{2-[ (pentan-3-yl) amino]-1,3-thiazol-4-yl}acetate lithium
FM124972-01	[ (1-Methyl-1H-indol-5-yl) methyl]amine acetate
HY-P0185A-01	Endomorphin 1 (acetate)
TRC-C591250-50MG	1-chloroethyl acetate
463330-01	Quensyl-1-acetate
268086-01	Chloramphenicol 1-acetate
409674-01	1-Dodecanol Acetate