5- (4-Fluorophenyl) pentan-1-amine

CAT: 0127-PC1003093-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1003093-01Size:100 mg

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CAS Number

1216003-55-2

MDL Number

MFCD14529677

Purity

95%

Smiles

NCCCCCC1=CC=C(F)C=C1

Chemical Information

5-(4-Fluorophenyl)pentan-1-amine

CAS Number	1216003-55-2
PubChem CID	64989061
IUPAC Name	5-(4-fluorophenyl)pentan-1-amine
Molecular Formula	C11H16FN
Molecular Weight	181.25
XLogP	2.6
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Heavy Atom Count	13
Formal Charge	0
Complexity	119

SMILES

C1=CC(=CC=C1CCCCCN)F

InChI

InChI=1S/C11H16FN/c12-11-7-5-10(6-8-11)4-2-1-3-9-13/h5-8H,1-4,9,13H2

InChIKey

VFCCGVDBQTUFMJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1216003-55-2

CID: 64989061

Formula: C11H16FN

MW: 181.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.25
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	5
Exact Mass	181.126677677
Monoisotopic Mass	181.126677677
Topological Polar Surface Area	26 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	119
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
PC101423-01	1- (3-Fluorophenyl) pentan-1-amine hydrochloride
PC110219-01	5-Chloro-1- (4-fluorophenyl) pentan-1-one
PC1001199	1- (4-Fluorophenyl) pentan-1-one
PC106466	1,5-Bis (4-fluorophenyl) pentan-3-one
OR77285-01	1- (4-Chlorophenyl) pentan-1-amine hydrochloride
OR86491-01	1- (4-Ethoxyphenyl) pentan-1-amine hydrochloride
PC4232	4- (4-Fluorophenyl) isoxazol-5-amine
OR1076738-01	Pentan-1-Amine Acetate
PC107684	5- (4-Fluorophenyl) pyrimidin-4-amine
OR1030348	Pentan-1-Amine Hydrochloride

Catalog	Name
RYB00355-01	5- (4-Fluorophenyl) pentan-1-amine
IDA94836-01	1- (4-Methoxyphenyl) pentan-1-amine
407981-01	1- (4-Bromo-2-fluorophenyl) pentan-1-one
ZKC19589-01	4-{[ (2-Fluorophenyl) methyl]amino}pentan-1-ol
SAA38080-01	1- (4-Fluorophenyl) cyclohexan-1-amine
AVD25983-01	4,4-Difluorospiro[2.2]pentan-1-amine hydrochloride
sc-333317	1-[ (4-fluorophenyl) methyl]piperidin-4-amine
GWB60269-01	1- (4-Fluorophenyl) -1H-pyrazol-4-amine
TPA86525-01	1- (4-Fluorophenyl) -N-methylpiperidin-4-amine
LIC70719-01	4- (4-Fluorophenyl) cyclohexan-1-amine hydrochloride