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Chemical structure of 2-Ethyl-6-methylphenol

GC61672

2-Ethyl-6-methylphenol

Also known as 2-ethyl-6-methylphenol

2-Ethyl-6-methylphenol, an alkylphenol, is isolated form the tumorigenic neutral subfraction of cigarette smoke condensate

ChemicalCAS1687-64-5MW136.19FormulaC9H12O
CAS number
1687-64-5
Molecular weight
136.19
Formula
C9H12O
Solubility
DMSO : 100 mg/mL (734·27 mM; Need ultrasonic)
InChIKey
CIRRFAQIWQFQSS-UHFFFAOYSA-N
Catalogue number
GC61672
Brand
GLPBIO
Computed properties PubChem CID 519333 · XLogP 2.6 · TPSA 20.2 Ų · H-bond donors 1
XLogP
2.6
TPSA
20.2 Ų
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
10

SMILES CCC1=CC=CC(=C1O)C

Computed descriptors from PubChem (CID 519333), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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