(2,3,4-trimethyl-5-phenylphenyl)methanol

C16H18O — CID 87491208

IUPAC(2,3,4-trimethyl-5-phenylphenyl)methanol
SMILESCc1c(CO)cc(-c2ccccc2)c(C)c1C
InChIInChI=1S/C16H18O/c1-11-12(2)15(10-17)9-16(13(11)3)14-7-5-4-6-8-14/h4-9,17H,10H2,1-3H3
InChIKeyGWOSUEXQQAIJPT-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.77
Rot. Bonds2

About (2,3,4-trimethyl-5-phenylphenyl)methanol

(2,3,4-trimethyl-5-phenylphenyl)methanol (PubChem CID 87491208) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is (2,3,4-trimethyl-5-phenylphenyl)methanol.

Molecular Properties

Compound Name(2,3,4-trimethyl-5-phenylphenyl)methanol
PubChem CID87491208
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name(2,3,4-trimethyl-5-phenylphenyl)methanol
SMILESCc1c(CO)cc(-c2ccccc2)c(C)c1C
InChIInChI=1S/C16H18O/c1-11-12(2)15(10-17)9-16(13(11)3)14-7-5-4-6-8-14/h4-9,17H,10H2,1-3H3
InChIKeyGWOSUEXQQAIJPT-UHFFFAOYSA-N
XLogP3.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2,3,4-trimethyl-5-phenylphenyl)methanol?
The IUPAC name of (2,3,4-trimethyl-5-phenylphenyl)methanol (CID 87491208) is (2,3,4-trimethyl-5-phenylphenyl)methanol.
What is the SMILES notation for (2,3,4-trimethyl-5-phenylphenyl)methanol?
The canonical SMILES for (2,3,4-trimethyl-5-phenylphenyl)methanol is Cc1c(CO)cc(-c2ccccc2)c(C)c1C.
What is the InChIKey of (2,3,4-trimethyl-5-phenylphenyl)methanol?
The InChIKey is GWOSUEXQQAIJPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-11-12(2)15(10-17)9-16(13(11)3)14-7-5-4-6-8-14/h4-9,17H,10H2,1-3H3.
What are the key properties of (2,3,4-trimethyl-5-phenylphenyl)methanol?
(2,3,4-trimethyl-5-phenylphenyl)methanol has a molecular weight of 226.32 g/mol, XLogP of 3.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4-trimethyl-5-phenylphenyl)methanol is sourced from PubChem (CID 87491208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).