3-(2-methylpropoxy)benzaldehyde

3-(2-methylpropoxy)benzaldehyde

CAS: 67698-69-5

Formula: C11H14O2

SMILES: CC(C)COC1=CC=CC(C=O)=C1

IUPAC: 3-(2-methylpropoxy)benzaldehyde

InChI: InChI=1S/C11H14O2/c1-9(2)8-13-11-5-3-4-10(6-11)7-12/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	0
Exact Mass	178.099379691
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KYAHWUCUKPTNKW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.85
Topological Polar Surface Area	26.3
Polarizability	20.26
Ring Count	1
Rotatable Bond Count	4

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