methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate

methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate

CAS: 114772-34-8

Formula: C15H14O2

SMILES: COC(=O)C1=CC=CC=C1C1=CC=C(C)C=C1

IUPAC: methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate

InChI: InChI=1S/C15H14O2/c1-11-7-9-12(10-8-11)13-5-3-4-6-14(13)15(16)17-2/h3-10H,1-2H3

Composition: C (79.62%), H (6.24%), O (14.14%)

Molar Mass: 226.275

Atom Count: 31

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	226.099379691
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	IHNIAWHITVGYJJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.26
Topological Polar Surface Area	26.3
Polarizability	27.53
Ring Count	2
Rotatable Bond Count	3

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