methyl (2R,3S)-3-amino-2-hydroxy-3-phenylpropanoate

methyl (2R,3S)-3-amino-2-hydroxy-3-phenylpropanoate

CAS: 131968-74-6

Formula: C10H13NO3

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

IUPAC: methyl (2R,3S)-3-amino-2-hydroxy-3-phenylpropanoate

InChI: InChI=1S/C10H13NO3/c1-14-10(13)9(12)8(11)7-5-3-2-4-6-7/h2-6,8-9,12H,11H2,1H3/t8-,9+/m0/s1

Composition: C (61.53%), H (6.71%), N (7.18%), O (24.59%)

Molar Mass: 195.218

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	195.089543283
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	WZPZWAQKLOPJEL-DTWKUNHWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.09
Topological Polar Surface Area	72.55
Polarizability	20.61
Ring Count	1
Rotatable Bond Count	4

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