2-methylpropyl 3-phenylprop-2-enoate

2-methylpropyl 3-phenylprop-2-enoate

CAS: 122-67-8

Formula: C13H16O2

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

IUPAC: 2-methylpropyl 3-phenylprop-2-enoate

InChI: InChI=1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3

Composition: C (76.44%), H (7.90%), O (15.66%)

Molar Mass: 204.269

Atom Count: 31

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	204.115029755
Formal Charge	0
FSP3	0.31
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	IQZUZPKOFSOVET-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.57
Topological Polar Surface Area	26.3
Polarizability	23.75
Ring Count	1
Rotatable Bond Count	5

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