methyl 2-hydroxy-3-phenylpropanoate

methyl 2-hydroxy-3-phenylpropanoate

CAS: 13674-16-3

Formula: C10H12O3

SMILES: COC(=O)C(O)CC1=CC=CC=C1

IUPAC: methyl 2-hydroxy-3-phenylpropanoate

InChI: InChI=1/C10H12O3/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3

Composition: C (66.65%), H (6.71%), O (26.63%)

Molar Mass: 180.203

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	180.078644246
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NMPPJJIBQQCOOI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.23
Topological Polar Surface Area	46.53
Polarizability	19.08
Ring Count	1
Rotatable Bond Count	4

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