(3R)-2-amino-3-hydroxy-3-phenylpropanoic acid

(3R)-2-amino-3-hydroxy-3-phenylpropanoic acid

CAS: 587-33-7

Formula: C9H11NO3

SMILES: NC([C@H](O)C1=CC=CC=C1)C(O)=O

IUPAC: (3R)-2-amino-3-hydroxy-3-phenylpropanoic acid

InChI: InChI=1S/C9H11NO3/c10-7(9(12)13)8(11)6-4-2-1-3-5-6/h1-5,7-8,11H,10H2,(H,12,13)/t7?,8-/m1/s1

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	181.073893218
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	VHVGNTVUSQUXPS-BRFYHDHCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.32
Topological Polar Surface Area	83.55
Polarizability	18.52
Ring Count	1
Rotatable Bond Count	3

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