(4-chlorophenyl)methanol;4-methylphenol

C14H15ClO2 — CID 158049041

IUPAC(4-chlorophenyl)methanol;4-methylphenol
SMILESCc1ccc(O)cc1.OCc1ccc(Cl)cc1
InChIInChI=1S/C7H7ClO.C7H8O/c8-7-3-1-6(5-9)2-4-7;1-6-2-4-7(8)5-3-6/h1-4,9H,5H2;2-5,8H,1H3
InChIKeyFJGKEFQSYUMQAU-UHFFFAOYSA-N
MW250.72 g/mol
LogP3.53
Rot. Bonds1

About (4-chlorophenyl)methanol;4-methylphenol

(4-chlorophenyl)methanol;4-methylphenol (PubChem CID 158049041) has the molecular formula C14H15ClO2 and a molecular weight of 250.72 g/mol. Its IUPAC name is (4-chlorophenyl)methanol;4-methylphenol.

Molecular Properties

Compound Name(4-chlorophenyl)methanol;4-methylphenol
PubChem CID158049041
Molecular FormulaC14H15ClO2
Molecular Weight250.72 g/mol
Exact Mass250.08
IUPAC Name(4-chlorophenyl)methanol;4-methylphenol
SMILESCc1ccc(O)cc1.OCc1ccc(Cl)cc1
InChIInChI=1S/C7H7ClO.C7H8O/c8-7-3-1-6(5-9)2-4-7;1-6-2-4-7(8)5-3-6/h1-4,9H,5H2;2-5,8H,1H3
InChIKeyFJGKEFQSYUMQAU-UHFFFAOYSA-N
XLogP3.53
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.72
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methylphenyl)methanol
CID 138734499
ethane;(4-methylphenyl)methanol;hydrate
CID 144684706
4-(hydroxymethyl)phenol;hydrate
CID 141133894
1-(4-chlorophenyl)-3-(4-methylphenyl)propan-2-ol
CID 60798023
[4-[(4-chlorophenyl)methyl]phenyl]methanol
CID 22408254
[4-[2-(4-chlorophenyl)ethyl]phenyl]methanol
CID 118032824
4-methylphenol
CID 70549076
4-chlorophenol
CID 4684
[4-[4-[[4-(4-methylphenyl)phenyl]methyl]phenyl]phenyl]methanol
CID 121329886
1-(iodomethyl)-4-methylbenzene;(4-methylphenyl)methanol
CID 157395568
4-chlorophenol;3,5-dimethylphenol
CID 160790221
bis(4-methylphenol);tetrahydrochloride
CID 175346853

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)methanol;4-methylphenol?
The IUPAC name of (4-chlorophenyl)methanol;4-methylphenol (CID 158049041) is (4-chlorophenyl)methanol;4-methylphenol.
What is the SMILES notation for (4-chlorophenyl)methanol;4-methylphenol?
The canonical SMILES for (4-chlorophenyl)methanol;4-methylphenol is Cc1ccc(O)cc1.OCc1ccc(Cl)cc1.
What is the InChIKey of (4-chlorophenyl)methanol;4-methylphenol?
The InChIKey is FJGKEFQSYUMQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClO.C7H8O/c8-7-3-1-6(5-9)2-4-7;1-6-2-4-7(8)5-3-6/h1-4,9H,5H2;2-5,8H,1H3.
What are the key properties of (4-chlorophenyl)methanol;4-methylphenol?
(4-chlorophenyl)methanol;4-methylphenol has a molecular weight of 250.72 g/mol, XLogP of 3.53, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)methanol;4-methylphenol is sourced from PubChem (CID 158049041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).