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1-Phenyl-cyclopentylamine

CAT: 0926-SAA38074-01Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-SAA38074-01Size:0.5 g
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CAS Number
17380-74-4
MDL Number
MFCD09903679
Smiles
C1CCC (C1) (C2=CC=CC=C2) N
Molecular Formula
C11H15N
Molecular Weight
161.25 g/mol
Controlled
Yes

Chemical Information

1-Phenylcyclopentylamine

structure given in first source

CAS Number17380-74-4
PubChem CID167651
IUPAC Name1-phenylcyclopentan-1-amine
Molecular FormulaC11H15N
Molecular Weight161.24
XLogP1.8
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity141
SMILES
C1CCC(C1)(C2=CC=CC=C2)N
InChI
InChI=1S/C11H15N/c12-11(8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2
InChIKey
YXAQCAOJLDGGDZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Phenylcyclopentylamine
CAS: 17380-74-4
CID: 167651
Formula: C11H15N
MW: 161.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight161.24
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass161.120449483
Monoisotopic Mass161.120449483
Topological Polar Surface Area26 Ų
Heavy Atom Count12
Formal Charge0
Complexity141
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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