3-ethyl-5-methylphenol

3-ethyl-5-methylphenol

CAS: 698-71-5

Formula: C9H12O

SMILES: CCC1=CC(C)=CC(O)=C1

IUPAC: 3-ethyl-5-methylphenol

InChI: InChI=1S/C9H12O/c1-3-8-4-7(2)5-9(10)6-8/h4-6,10H,3H2,1-2H3

Composition: C (79.37%), H (8.88%), O (11.75%)

Molar Mass: 136.194

Atom Count: 22

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	136.088815006
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	XTCHLXABLZQNNN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.72
Topological Polar Surface Area	20.23
Polarizability	16.32
Ring Count	1
Rotatable Bond Count	1

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