phenylmethanol;tetrachloromethane

C8H8Cl4O — CID 174952839

IUPACphenylmethanol;tetrachloromethane
SMILESClC(Cl)(Cl)Cl.OCc1ccccc1
InChIInChI=1S/C7H8O.CCl4/c8-6-7-4-2-1-3-5-7;2-1(3,4)5/h1-5,8H,6H2;
InChIKeyFFRJXBQBCOJYFO-UHFFFAOYSA-N
MW261.96 g/mol
LogP3.73
Rot. Bonds1

About phenylmethanol;tetrachloromethane

phenylmethanol;tetrachloromethane (PubChem CID 174952839) has the molecular formula C8H8Cl4O and a molecular weight of 261.96 g/mol. Its IUPAC name is phenylmethanol;tetrachloromethane.

Molecular Properties

Compound Namephenylmethanol;tetrachloromethane
PubChem CID174952839
Molecular FormulaC8H8Cl4O
Molecular Weight261.96 g/mol
Exact Mass259.93
IUPAC Namephenylmethanol;tetrachloromethane
SMILESClC(Cl)(Cl)Cl.OCc1ccccc1
InChIInChI=1S/C7H8O.CCl4/c8-6-7-4-2-1-3-5-7;2-1(3,4)5/h1-5,8H,6H2;
InChIKeyFFRJXBQBCOJYFO-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.96
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze phenylmethanol;tetrachloromethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

phenylmethanol;tetrabromomethane
CID 174808232
phenylmethanol;tungsten
CID 166544439
phenylmethanol;hydrate
CID 68812705
phenylmethanol;zirconium
CID 18688174
methanol;phenylmethanol
CID 19822462
phenylmethanol;titanium;dihydrochloride
CID 88632851
ethane-1,2-diol;phenylmethanol
CID 69228462
disodium;hydride;phenylmethanol
CID 174792747
sodium;phenylmethanol;hydroxide
CID 67303637
molecular hydrogen;phenylmethanol
CID 158888584
phenylmethanol;phosphane;trihydrobromide
CID 174749424
azane;phenylmethanol;hydrochloride
CID 173141367

Frequently Asked Questions

What is the IUPAC name of phenylmethanol;tetrachloromethane?
The IUPAC name of phenylmethanol;tetrachloromethane (CID 174952839) is phenylmethanol;tetrachloromethane.
What is the SMILES notation for phenylmethanol;tetrachloromethane?
The canonical SMILES for phenylmethanol;tetrachloromethane is ClC(Cl)(Cl)Cl.OCc1ccccc1.
What is the InChIKey of phenylmethanol;tetrachloromethane?
The InChIKey is FFRJXBQBCOJYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O.CCl4/c8-6-7-4-2-1-3-5-7;2-1(3,4)5/h1-5,8H,6H2;.
What are the key properties of phenylmethanol;tetrachloromethane?
phenylmethanol;tetrachloromethane has a molecular weight of 261.96 g/mol, XLogP of 3.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenylmethanol;tetrachloromethane is sourced from PubChem (CID 174952839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).