1-tert-butyl-3-ethoxybenzene

1-tert-butyl-3-ethoxybenzene

CAS: 133073-81-1

Formula: C12H18O

SMILES: CCOC1=CC=CC(=C1)C(C)(C)C

IUPAC: 1-tert-butyl-3-ethoxybenzene

InChI: InChI=1S/C12H18O/c1-5-13-11-8-6-7-10(9-11)12(2,3)4/h6-9H,5H2,1-4H3

Composition: C (80.85%), H (10.18%), O (8.97%)

Molar Mass: 178.275

Atom Count: 31

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	178.1357652
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	GPRQWDZTBQWUAT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.94
Topological Polar Surface Area	9.23
Polarizability	22.01
Ring Count	1
Rotatable Bond Count	3

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