[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol

C10H10ClF3O — CID 87995556

IUPAC[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol
SMILESOCc1c(Cl)cc(CF)c(CF)c1CF
InChIInChI=1S/C10H10ClF3O/c11-10-1-6(2-12)7(3-13)8(4-14)9(10)5-15/h1,15H,2-5H2
InChIKeyCJAHZXDBXSPEKV-UHFFFAOYSA-N
MW238.64 g/mol
LogP3.24
Rot. Bonds4

About [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol

[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol (PubChem CID 87995556) has the molecular formula C10H10ClF3O and a molecular weight of 238.64 g/mol. Its IUPAC name is [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol
PubChem CID87995556
Molecular FormulaC10H10ClF3O
Molecular Weight238.64 g/mol
Exact Mass238.04
IUPAC Name[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol
SMILESOCc1c(Cl)cc(CF)c(CF)c1CF
InChIInChI=1S/C10H10ClF3O/c11-10-1-6(2-12)7(3-13)8(4-14)9(10)5-15/h1,15H,2-5H2
InChIKeyCJAHZXDBXSPEKV-UHFFFAOYSA-N
XLogP3.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.64
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol 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

[3-chloro-4-(fluoromethyl)phenyl]methanol
CID 88976698
(2,4-dichloro-6-fluorophenyl)methanol
CID 118642652
1-chloro-2,4-difluoro-5-(fluoromethyl)benzene
CID 118802249
[4-amino-2-chloro-6-(trifluoromethyl)phenyl]methanol
CID 118812382
[5-chloro-2,3-difluoro-4-(methoxymethyl)phenyl]methanol
CID 117318845
[2-amino-4-chloro-6-(difluoromethyl)-3-pyridinyl]methanol
CID 119002852
(2,4,6-trichloro-3-pyridinyl)methanol
CID 71301503
3-chloro-4,5-bis(hydroxymethyl)benzoic acid
CID 90442235
3-chloro-5-fluoro-4-(hydroxymethyl)benzoic acid
CID 130219313
1,4-dichloro-2-(fluoromethyl)benzene
CID 175609206
(2-bromo-4,5-dichlorophenyl)methanol
CID 68615356
2,5-dichloro-3-fluoro-4-(hydroxymethyl)benzoic acid
CID 130219312

Frequently Asked Questions

What is the IUPAC name of [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol?
The IUPAC name of [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol (CID 87995556) is [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol.
What is the SMILES notation for [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol?
The canonical SMILES for [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol is OCc1c(Cl)cc(CF)c(CF)c1CF.
What is the InChIKey of [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol?
The InChIKey is CJAHZXDBXSPEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClF3O/c11-10-1-6(2-12)7(3-13)8(4-14)9(10)5-15/h1,15H,2-5H2.
What are the key properties of [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol?
[6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol has a molecular weight of 238.64 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-2,3,4-tris(fluoromethyl)phenyl]methanol is sourced from PubChem (CID 87995556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).