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2-Phenylcyclobutan-1-amine

CAT: 0926-SAA29344-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-SAA29344-01Size:50 mg
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CAS Number
17293-44-6
MDL Number
MFCD19210030
Smiles
C1CC (C1C2=CC=CC=C2) N
Molecular Formula
C10H13N
Molecular Weight
147.22 g/mol
Controlled
No

Chemical Information

2-Phenylcyclobutanamine
CAS Number17293-44-6
PubChem CID19703781
IUPAC Name2-phenylcyclobutan-1-amine
Molecular FormulaC10H13N
Molecular Weight147.22
XLogP1.8
Topological Polar Surface Area26
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity127
SMILES
C1CC(C1C2=CC=CC=C2)N
InChI
InChI=1S/C10H13N/c11-10-7-6-9(10)8-4-2-1-3-5-8/h1-5,9-10H,6-7,11H2
InChIKey
PKMQLQANCCIABY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Phenylcyclobutanamine
CAS: 17293-44-6
CID: 19703781
Formula: C10H13N
MW: 147.22
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight147.22
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass147.104799419
Monoisotopic Mass147.104799419
Topological Polar Surface Area26 Ų
Heavy Atom Count11
Formal Charge0
Complexity127
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes