(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol

C13H9Cl2FO — CID 7153378

IUPAC(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
SMILESO[C@H](c1cccc(F)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H9Cl2FO/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,13,17H/t13-/m1/s1
InChIKeyAJSRWWZTOYPQPT-CYBMUJFWSA-N
MW271.12 g/mol
LogP4.21
Rot. Bonds2

About (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol

(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol (PubChem CID 7153378) has the molecular formula C13H9Cl2FO and a molecular weight of 271.12 g/mol. Its IUPAC name is (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol.

Molecular Properties

Compound Name(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
PubChem CID7153378
Molecular FormulaC13H9Cl2FO
Molecular Weight271.12 g/mol
Exact Mass270.00
IUPAC Name(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
SMILESO[C@H](c1cccc(F)c1)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C13H9Cl2FO/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,13,17H/t13-/m1/s1
InChIKeyAJSRWWZTOYPQPT-CYBMUJFWSA-N
XLogP4.21
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 ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chloro-4-methoxyphenyl)-(3-fluorophenyl)methanol
CID 61101567
(R)-(3,4-dichlorophenyl)-phenylmethanol
CID 7153278
(R)-(3-chloro-5-fluorophenyl)-(3-fluorophenyl)methanol
CID 7146499
(1R)-N-[1-(3,4-dichlorophenyl)ethyl]-1-(3-fluorophenyl)ethanamine
CID 81369376
(2-chloro-6-fluorophenyl)-(3-fluorophenyl)methanol
CID 63896004
(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
CID 61083356
N-[(3,4-dichlorophenyl)-(3-fluorophenyl)methyl]ethanamine
CID 43492851
(3-cyclopropylphenyl)-(3,4-dichlorophenyl)methanol
CID 79980407
(3-chlorophenyl)-(3,5-difluorophenyl)methanol
CID 2757448
(3,5-dibromophenyl)-(3-fluorophenyl)methanol
CID 107978141
(S)-(3-fluorophenyl)-(4-methoxyphenyl)methanol
CID 7154378
(S)-(3-chloro-5-fluorophenyl)-(3-chlorophenyl)methanol
CID 7153369

Frequently Asked Questions

What is the IUPAC name of (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol?
The IUPAC name of (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol (CID 7153378) is (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol.
What is the SMILES notation for (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol?
The canonical SMILES for (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol is O[C@H](c1cccc(F)c1)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol?
The InChIKey is AJSRWWZTOYPQPT-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H9Cl2FO/c14-11-5-4-9(7-12(11)15)13(17)8-2-1-3-10(16)6-8/h1-7,13,17H/t13-/m1/s1.
What are the key properties of (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol?
(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol has a molecular weight of 271.12 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol is sourced from PubChem (CID 7153378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).