benzyl 2-hydroxy-2-methylpropanoate

benzyl 2-hydroxy-2-methylpropanoate

CAS: 19444-23-6

Formula: C11H14O3

SMILES: CC(C)(O)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 2-hydroxy-2-methylpropanoate

InChI: InChI=1S/C11H14O3/c1-11(2,13)10(12)14-8-9-6-4-3-5-7-9/h3-7,13H,8H2,1-2H3

Composition: C (68.02%), H (7.27%), O (24.71%)

Molar Mass: 194.23

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	194.094294311
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KLUBEEQODOBJQB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.93
Topological Polar Surface Area	46.53
Polarizability	20.92
Ring Count	1
Rotatable Bond Count	4

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