(2-chloro-4-fluorophenyl)methanol

C7H6ClFO — CID 4982711

IUPAC(2-chloro-4-fluorophenyl)methanol
SMILESOCc1ccc(F)cc1Cl
InChIInChI=1S/C7H6ClFO/c8-7-3-6(9)2-1-5(7)4-10/h1-3,10H,4H2
InChIKeyZUHMDLLAHZUDRE-UHFFFAOYSA-N
MW160.57 g/mol
LogP1.97
Rot. Bonds1

About (2-chloro-4-fluorophenyl)methanol

(2-chloro-4-fluorophenyl)methanol (PubChem CID 4982711) has the molecular formula C7H6ClFO and a molecular weight of 160.57 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl)methanol
PubChem CID4982711
Molecular FormulaC7H6ClFO
Molecular Weight160.57 g/mol
Exact Mass160.01
IUPAC Name(2-chloro-4-fluorophenyl)methanol
SMILESOCc1ccc(F)cc1Cl
InChIInChI=1S/C7H6ClFO/c8-7-3-6(9)2-1-5(7)4-10/h1-3,10H,4H2
InChIKeyZUHMDLLAHZUDRE-UHFFFAOYSA-N
XLogP1.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.57
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-Dichlorobenzyl alcohol
CID 15684
4-Chlorobenzyl alcohol
CID 13397
2,3-Difluorobenzyl Alcohol
CID 447153
Benzenemethanol, 2,6-dichloro-
CID 27156
3-Chlorobenzyl alcohol
CID 70117
2,4-Difluorobenzyl alcohol
CID 91867
2-Fluorobenzylic alcohol
CID 67969
Benzenemethanol, 4-chloro-alpha-methyl-
CID 18825
(2,3-Dichlorophenyl)methanol
CID 228603
3-Fluorobenzylic alcohol
CID 68008
3,5-Dichlorobenzylic alcohol
CID 43236
4-Fluorobenzylic alcohol
CID 68022

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl)methanol?
The IUPAC name of (2-chloro-4-fluorophenyl)methanol (CID 4982711) is (2-chloro-4-fluorophenyl)methanol.
What is the SMILES notation for (2-chloro-4-fluorophenyl)methanol?
The canonical SMILES for (2-chloro-4-fluorophenyl)methanol is OCc1ccc(F)cc1Cl.
What is the InChIKey of (2-chloro-4-fluorophenyl)methanol?
The InChIKey is ZUHMDLLAHZUDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClFO/c8-7-3-6(9)2-1-5(7)4-10/h1-3,10H,4H2.
What are the key properties of (2-chloro-4-fluorophenyl)methanol?
(2-chloro-4-fluorophenyl)methanol has a molecular weight of 160.57 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl)methanol is sourced from PubChem (CID 4982711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).