methyl 2-methyl-3-phenylpropanoate

methyl 2-methyl-3-phenylpropanoate

Formula: C11H14O2

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

IUPAC: methyl 2-methyl-3-phenylpropanoate

InChI: InChI=1/C11H14O2/c1-9(11(12)13-2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3

Composition: C (74.13%), H (7.92%), O (17.95%)

Molar Mass: 178.231

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	178.099379691
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	ZQDZXEFWUCNPMG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.31
Topological Polar Surface Area	26.3
Polarizability	20.3
Ring Count	1
Rotatable Bond Count	4

Suppliers

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H14O2		Quote Only