(2,4-dichloro-5-fluorophenyl)methanol

C7H5Cl2FO — CID 2774017

IUPAC(2,4-dichloro-5-fluorophenyl)methanol
SMILESOCc1cc(F)c(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2FO/c8-5-2-6(9)7(10)1-4(5)3-11/h1-2,11H,3H2
InChIKeyJSYAJRDFLAMNMF-UHFFFAOYSA-N
MW195.02 g/mol
LogP2.62
Rot. Bonds1

About (2,4-dichloro-5-fluorophenyl)methanol

(2,4-dichloro-5-fluorophenyl)methanol (PubChem CID 2774017) has the molecular formula C7H5Cl2FO and a molecular weight of 195.02 g/mol. Its IUPAC name is (2,4-dichloro-5-fluorophenyl)methanol.

Molecular Properties

Compound Name(2,4-dichloro-5-fluorophenyl)methanol
PubChem CID2774017
Molecular FormulaC7H5Cl2FO
Molecular Weight195.02 g/mol
Exact Mass193.97
IUPAC Name(2,4-dichloro-5-fluorophenyl)methanol
SMILESOCc1cc(F)c(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2FO/c8-5-2-6(9)7(10)1-4(5)3-11/h1-2,11H,3H2
InChIKeyJSYAJRDFLAMNMF-UHFFFAOYSA-N
XLogP2.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.02
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

(4-chloro-5-fluoro-2-nitrophenyl)methanol
CID 91619131
2-(2,4-dichloro-5-fluorophenyl)acetonitrile
CID 2774021
1-chloro-4-(chloromethyl)-2-fluoro-5-methylbenzene
CID 131117181
1-[1-[(2,4-dichloro-5-fluorophenyl)methyl]piperidin-4-yl]ethane-1,2-diol
CID 138378455
[4-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 171009321
2-(2-amino-4-chloro-5-fluorophenyl)acetic acid
CID 19763734
1-(4-chloro-2,5-difluorophenyl)pent-3-yn-1-ol
CID 115780031
1-chloro-2-fluoro-4-(fluoromethyl)-5-methylbenzene
CID 130952745
2-chloro-5-(hydroxymethyl)benzene-1,4-diol
CID 55253170
1-chloro-2,4-difluoro-5-(fluoromethyl)benzene
CID 118802249
[4-(3,4-dichlorophenyl)-2-fluorophenyl]methanol
CID 118801795
N-[(4-chloro-5-fluoro-2-methylphenyl)methyl]-N-methylhydroxylamine
CID 84777598

Frequently Asked Questions

What is the IUPAC name of (2,4-dichloro-5-fluorophenyl)methanol?
The IUPAC name of (2,4-dichloro-5-fluorophenyl)methanol (CID 2774017) is (2,4-dichloro-5-fluorophenyl)methanol.
What is the SMILES notation for (2,4-dichloro-5-fluorophenyl)methanol?
The canonical SMILES for (2,4-dichloro-5-fluorophenyl)methanol is OCc1cc(F)c(Cl)cc1Cl.
What is the InChIKey of (2,4-dichloro-5-fluorophenyl)methanol?
The InChIKey is JSYAJRDFLAMNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2FO/c8-5-2-6(9)7(10)1-4(5)3-11/h1-2,11H,3H2.
What are the key properties of (2,4-dichloro-5-fluorophenyl)methanol?
(2,4-dichloro-5-fluorophenyl)methanol has a molecular weight of 195.02 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichloro-5-fluorophenyl)methanol is sourced from PubChem (CID 2774017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).