(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol

C17H19BrO2 — CID 62302334

IUPAC(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol
SMILESCCOc1ccc(C)cc1C(O)c1ccc(Br)cc1C
InChIInChI=1S/C17H19BrO2/c1-4-20-16-8-5-11(2)9-15(16)17(19)14-7-6-13(18)10-12(14)3/h5-10,17,19H,4H2,1-3H3
InChIKeyGQPGSNFQPGESLX-UHFFFAOYSA-N
MW335.24 g/mol
LogP4.55
Rot. Bonds4

About (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol

(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol (PubChem CID 62302334) has the molecular formula C17H19BrO2 and a molecular weight of 335.24 g/mol. Its IUPAC name is (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol
PubChem CID62302334
Molecular FormulaC17H19BrO2
Molecular Weight335.24 g/mol
Exact Mass334.06
IUPAC Name(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol
SMILESCCOc1ccc(C)cc1C(O)c1ccc(Br)cc1C
InChIInChI=1S/C17H19BrO2/c1-4-20-16-8-5-11(2)9-15(16)17(19)14-7-6-13(18)10-12(14)3/h5-10,17,19H,4H2,1-3H3
InChIKeyGQPGSNFQPGESLX-UHFFFAOYSA-N
XLogP4.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.24
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-ethoxyphenyl)-(5-bromo-2-methylphenyl)methanol
CID 65306945
(4-bromo-2-methylphenyl)-(2,4-dimethylphenyl)methanol
CID 61101101
(2-ethoxy-5-methylphenyl)-(2-methylphenyl)methanol
CID 62302666
(5-bromo-2-ethoxyphenyl)-(2,4-dimethylphenyl)methanamine
CID 43311344
2,4-dibromo-1-[bromo-(2-ethoxy-5-methylphenyl)methyl]benzene
CID 107958857
(5-bromo-2-ethoxyphenyl)-(4-bromophenyl)methanol
CID 61081643
1-(5-bromo-2-ethoxyphenyl)-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 43487365
(2-chloro-4-fluorophenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 62303344
(2,4-dibromophenyl)-(2,4-dimethylphenyl)methanol
CID 107947470
(2-bromo-4-chlorophenyl)-(5-bromo-2-ethoxyphenyl)methanol
CID 107991194
(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol
CID 61083035
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
CID 63364902

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol?
The IUPAC name of (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol (CID 62302334) is (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol.
What is the SMILES notation for (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol?
The canonical SMILES for (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol is CCOc1ccc(C)cc1C(O)c1ccc(Br)cc1C.
What is the InChIKey of (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol?
The InChIKey is GQPGSNFQPGESLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrO2/c1-4-20-16-8-5-11(2)9-15(16)17(19)14-7-6-13(18)10-12(14)3/h5-10,17,19H,4H2,1-3H3.
What are the key properties of (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol?
(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol has a molecular weight of 335.24 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol is sourced from PubChem (CID 62302334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).