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3-amino-5-phenylpentanoic acid

3-amino-5-phenylpentanoic acid

CAS: 91247-38-0

Formula: C11H15NO2

SMILES: NC(CCC1=CC=CC=C1)CC(O)=O

IUPAC: 3-amino-5-phenylpentanoic acid

InChI: InChI=1/C11H15NO2/c12-10(8-11(13)14)7-6-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 193.110278727
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CJJYCYZKUNRKFP-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.34
Topological Polar Surface Area 63.32
Polarizability 21.49
Ring Count 1
Rotatable Bond Count 5

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