1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol

C15H13Cl2FO — CID 65316898

IUPAC1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(Cl)ccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C15H13Cl2FO/c1-15(19,11-2-5-13(18)6-3-11)9-10-8-12(16)4-7-14(10)17/h2-8,19H,9H2,1H3
InChIKeyNFAIRYLZZALFSA-UHFFFAOYSA-N
MW299.17 g/mol
LogP4.58
Rot. Bonds3

About 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol

1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol (PubChem CID 65316898) has the molecular formula C15H13Cl2FO and a molecular weight of 299.17 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol
PubChem CID65316898
Molecular FormulaC15H13Cl2FO
Molecular Weight299.17 g/mol
Exact Mass298.03
IUPAC Name1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(Cl)ccc1Cl)c1ccc(F)cc1
InChIInChI=1S/C15H13Cl2FO/c1-15(19,11-2-5-13(18)6-3-11)9-10-8-12(16)4-7-14(10)17/h2-8,19H,9H2,1H3
InChIKeyNFAIRYLZZALFSA-UHFFFAOYSA-N
XLogP4.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-chloro-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 103047472
1-(2,5-dichlorophenyl)-2-(3,4-dimethylphenyl)propan-2-ol
CID 65316570
4-[1-(2-chloro-5-fluorophenyl)-2-hydroxypropan-2-yl]phenol
CID 102617435
1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 65145030
4-[1-(5-chloro-2-fluorophenyl)-2-hydroxypropan-2-yl]benzonitrile
CID 103047735
1-(2,5-dichlorophenyl)-2-(2,5-dimethylphenyl)propan-2-ol
CID 65316614
2-(3-bromophenyl)-1-(5-chloro-2-fluorophenyl)propan-2-ol
CID 103047480
1-(2-chloro-5-fluorophenyl)-2-(2,5-dimethylphenyl)propan-2-ol
CID 102617180
1-(2-chloro-3-fluorophenyl)-2-(4-chlorophenyl)propan-2-ol
CID 112652946
2-(4-chlorophenyl)-1-(3,4-dichlorophenyl)propan-2-ol
CID 65145380
1-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)ethanol
CID 58392419
1-(5-chloro-2-fluorophenyl)-2-(2-fluorophenyl)propan-2-ol
CID 103047475

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol (CID 65316898) is 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol is CC(O)(Cc1cc(Cl)ccc1Cl)c1ccc(F)cc1.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The InChIKey is NFAIRYLZZALFSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO/c1-15(19,11-2-5-13(18)6-3-11)9-10-8-12(16)4-7-14(10)17/h2-8,19H,9H2,1H3.
What are the key properties of 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol?
1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol has a molecular weight of 299.17 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol is sourced from PubChem (CID 65316898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).