benzene;2-ethylphenol

C14H16O — CID 159726745

IUPACbenzene;2-ethylphenol
SMILESCCc1ccccc1O.c1ccccc1
InChIInChI=1S/C8H10O.C6H6/c1-2-7-5-3-4-6-8(7)9;1-2-4-6-5-3-1/h3-6,9H,2H2,1H3;1-6H
InChIKeyNASPPUKURYESFJ-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.64
Rot. Bonds1

About benzene;2-ethylphenol

benzene;2-ethylphenol (PubChem CID 159726745) has the molecular formula C14H16O and a molecular weight of 200.28 g/mol. Its IUPAC name is benzene;2-ethylphenol.

Molecular Properties

Compound Namebenzene;2-ethylphenol
PubChem CID159726745
Molecular FormulaC14H16O
Molecular Weight200.28 g/mol
Exact Mass200.12
IUPAC Namebenzene;2-ethylphenol
SMILESCCc1ccccc1O.c1ccccc1
InChIInChI=1S/C8H10O.C6H6/c1-2-7-5-3-4-6-8(7)9;1-2-4-6-5-3-1/h3-6,9H,2H2,1H3;1-6H
InChIKeyNASPPUKURYESFJ-UHFFFAOYSA-N
XLogP3.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of benzene;2-ethylphenol?
The IUPAC name of benzene;2-ethylphenol (CID 159726745) is benzene;2-ethylphenol.
What is the SMILES notation for benzene;2-ethylphenol?
The canonical SMILES for benzene;2-ethylphenol is CCc1ccccc1O.c1ccccc1.
What is the InChIKey of benzene;2-ethylphenol?
The InChIKey is NASPPUKURYESFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O.C6H6/c1-2-7-5-3-4-6-8(7)9;1-2-4-6-5-3-1/h3-6,9H,2H2,1H3;1-6H.
What are the key properties of benzene;2-ethylphenol?
benzene;2-ethylphenol has a molecular weight of 200.28 g/mol, XLogP of 3.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-ethylphenol is sourced from PubChem (CID 159726745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).