[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol

C13H9Cl2FO — CID 118801795

IUPAC[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol
SMILESOCc1ccc(-c2ccc(Cl)c(Cl)c2)cc1F
InChIInChI=1S/C13H9Cl2FO/c14-11-4-3-8(5-12(11)15)9-1-2-10(7-17)13(16)6-9/h1-6,17H,7H2
InChIKeyFNIKKMSAVNBVTA-UHFFFAOYSA-N
MW271.12 g/mol
LogP4.29
Rot. Bonds2

About [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol

[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol (PubChem CID 118801795) has the molecular formula C13H9Cl2FO and a molecular weight of 271.12 g/mol. Its IUPAC name is [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol.

Molecular Properties

Compound Name[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol
PubChem CID118801795
Molecular FormulaC13H9Cl2FO
Molecular Weight271.12 g/mol
Exact Mass270.00
IUPAC Name[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol
SMILESOCc1ccc(-c2ccc(Cl)c(Cl)c2)cc1F
InChIInChI=1S/C13H9Cl2FO/c14-11-4-3-8(5-12(11)15)9-1-2-10(7-17)13(16)6-9/h1-6,17H,7H2
InChIKeyFNIKKMSAVNBVTA-UHFFFAOYSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.12
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[5-chloro-2-(3,4-dichlorophenyl)phenyl]methanol
CID 71251754
1,2-dichloro-4-[4-(difluoromethyl)-3-fluorophenyl]benzene
CID 134623230
[2-chloro-5-(3,4-dichlorophenyl)-3-pyridinyl]methanol
CID 119006015
[4-(4-ethenylphenyl)-2-fluorophenyl]methanol
CID 89129319
[2-fluoro-4-(4-methoxyphenyl)phenyl]methanol
CID 11207006
[2-fluoro-4-[1-(trifluoromethyl)pyrazol-4-yl]phenyl]methanol
CID 166089100
[2-(3,4-dichlorophenyl)-6-fluorophenyl]methanol
CID 118813063
[5-(2,5-dichlorophenyl)-2-fluorophenyl]methanol
CID 118824338
1,2-dichloro-4-(3,5-difluorophenyl)benzene
CID 134623188
2-[4-(3-chloro-4-fluorophenyl)-2-fluorophenyl]acetonitrile
CID 175670145
(2R)-2-amino-2-[4-(3,4-dichlorophenyl)phenyl]ethanol
CID 66515616
[2-fluoro-4-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]phenyl]methanol
CID 164885241

Frequently Asked Questions

What is the IUPAC name of [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol?
The IUPAC name of [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol (CID 118801795) is [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol.
What is the SMILES notation for [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol?
The canonical SMILES for [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol is OCc1ccc(-c2ccc(Cl)c(Cl)c2)cc1F.
What is the InChIKey of [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol?
The InChIKey is FNIKKMSAVNBVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2FO/c14-11-4-3-8(5-12(11)15)9-1-2-10(7-17)13(16)6-9/h1-6,17H,7H2.
What are the key properties of [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol?
[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol has a molecular weight of 271.12 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol is sourced from PubChem (CID 118801795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).