(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol

C14H11Br2ClO — CID 81324953

IUPAC(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol
SMILESCc1cc(Cl)cc(C(O)c2cc(Br)ccc2Br)c1
InChIInChI=1S/C14H11Br2ClO/c1-8-4-9(6-11(17)5-8)14(18)12-7-10(15)2-3-13(12)16/h2-7,14,18H,1H3
InChIKeyQQUFPALVQLPLOZ-UHFFFAOYSA-N
MW390.50 g/mol
LogP5.26
Rot. Bonds2

About (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol

(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol (PubChem CID 81324953) has the molecular formula C14H11Br2ClO and a molecular weight of 390.50 g/mol. Its IUPAC name is (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol.

Molecular Properties

Compound Name(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol
PubChem CID81324953
Molecular FormulaC14H11Br2ClO
Molecular Weight390.50 g/mol
Exact Mass387.89
IUPAC Name(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol
SMILESCc1cc(Cl)cc(C(O)c2cc(Br)ccc2Br)c1
InChIInChI=1S/C14H11Br2ClO/c1-8-4-9(6-11(17)5-8)14(18)12-7-10(15)2-3-13(12)16/h2-7,14,18H,1H3
InChIKeyQQUFPALVQLPLOZ-UHFFFAOYSA-N
XLogP5.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.50
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5-bromo-2-ethoxyphenyl)-(3-chloro-5-methylphenyl)methanol
CID 81324876
(4-bromothiophen-3-yl)-(3-chloro-5-methylphenyl)methanol
CID 115820132
(2,4-dibromophenyl)-(3,5-dimethylphenyl)methanol
CID 107947280
(4-bromo-2,5-dimethoxyphenyl)-(3-chloro-5-methylphenyl)methanol
CID 105057119
(2,5-dibromophenyl)-(3,4-dichlorophenyl)methanol
CID 63426086
1,4-dibromo-2-[bromo-(3,5-dimethylphenyl)methyl]benzene
CID 63437775
(5-bromo-2-fluorophenyl)-(3-chloro-5-methylphenyl)methanamine
CID 105011988
(2-bromo-4-chlorophenyl)-(2,5-dibromophenyl)methanol
CID 114024842
(5-bromo-2-fluorophenyl)-(2-bromo-5-methylphenyl)methanol
CID 115820779
(7-bromo-1-benzothiophen-3-yl)-(3-chloro-5-methylphenyl)methanol
CID 81324957
(R)-(2-bromophenyl)-(3,5-dichlorophenyl)methanol
CID 97293471
(3-bromo-4-ethoxyphenyl)-(3-chloro-5-methylphenyl)methanol
CID 104661029

Frequently Asked Questions

What is the IUPAC name of (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol?
The IUPAC name of (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol (CID 81324953) is (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol.
What is the SMILES notation for (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol?
The canonical SMILES for (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol is Cc1cc(Cl)cc(C(O)c2cc(Br)ccc2Br)c1.
What is the InChIKey of (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol?
The InChIKey is QQUFPALVQLPLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2ClO/c1-8-4-9(6-11(17)5-8)14(18)12-7-10(15)2-3-13(12)16/h2-7,14,18H,1H3.
What are the key properties of (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol?
(3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol has a molecular weight of 390.50 g/mol, XLogP of 5.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-5-methylphenyl)-(2,5-dibromophenyl)methanol is sourced from PubChem (CID 81324953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).