1-methoxy-2-(3-methylbut-3-en-1-yl)benzene

1-methoxy-2-(3-methylbut-3-en-1-yl)benzene

CAS: 18272-85-0

Formula: C12H16O

SMILES: COC1=CC=CC=C1CCC(C)=C

IUPAC: 1-methoxy-2-(3-methylbut-3-en-1-yl)benzene

InChI: InChI=1S/C12H16O/c1-10(2)8-9-11-6-4-5-7-12(11)13-3/h4-7H,1,8-9H2,2-3H3

Composition: C (81.77%), H (9.15%), O (9.08%)

Molar Mass: 176.259

Atom Count: 29

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	176.120115135
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	IINXAZCHKJVJSX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.69
Topological Polar Surface Area	9.23
Polarizability	21.78
Ring Count	1
Rotatable Bond Count	4

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