3-(3,4,5-trimethylphenyl)phenol

C15H16O — CID 101298838

IUPAC3-(3,4,5-trimethylphenyl)phenol
SMILESCc1cc(-c2cccc(O)c2)cc(C)c1C
InChIInChI=1S/C15H16O/c1-10-7-14(8-11(2)12(10)3)13-5-4-6-15(16)9-13/h4-9,16H,1-3H3
InChIKeyRZALRIUVCPDRPC-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.98
Rot. Bonds1

About 3-(3,4,5-trimethylphenyl)phenol

3-(3,4,5-trimethylphenyl)phenol (PubChem CID 101298838) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 3-(3,4,5-trimethylphenyl)phenol.

Molecular Properties

Compound Name3-(3,4,5-trimethylphenyl)phenol
PubChem CID101298838
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name3-(3,4,5-trimethylphenyl)phenol
SMILESCc1cc(-c2cccc(O)c2)cc(C)c1C
InChIInChI=1S/C15H16O/c1-10-7-14(8-11(2)12(10)3)13-5-4-6-15(16)9-13/h4-9,16H,1-3H3
InChIKeyRZALRIUVCPDRPC-UHFFFAOYSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4,5-trimethylphenyl)phenol?
The IUPAC name of 3-(3,4,5-trimethylphenyl)phenol (CID 101298838) is 3-(3,4,5-trimethylphenyl)phenol.
What is the SMILES notation for 3-(3,4,5-trimethylphenyl)phenol?
The canonical SMILES for 3-(3,4,5-trimethylphenyl)phenol is Cc1cc(-c2cccc(O)c2)cc(C)c1C.
What is the InChIKey of 3-(3,4,5-trimethylphenyl)phenol?
The InChIKey is RZALRIUVCPDRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-10-7-14(8-11(2)12(10)3)13-5-4-6-15(16)9-13/h4-9,16H,1-3H3.
What are the key properties of 3-(3,4,5-trimethylphenyl)phenol?
3-(3,4,5-trimethylphenyl)phenol has a molecular weight of 212.29 g/mol, XLogP of 3.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4,5-trimethylphenyl)phenol is sourced from PubChem (CID 101298838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).