(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone

C14H10Br2O2 — CID 43161777

IUPAC(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone
SMILESCOc1ccc(Br)cc1C(=O)c1cccc(Br)c1
InChIInChI=1S/C14H10Br2O2/c1-18-13-6-5-11(16)8-12(13)14(17)9-3-2-4-10(15)7-9/h2-8H,1H3
InChIKeyUJEQBDCVLKBSNY-UHFFFAOYSA-N
MW370.04 g/mol
LogP4.45
Rot. Bonds3

About (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone

(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone (PubChem CID 43161777) has the molecular formula C14H10Br2O2 and a molecular weight of 370.04 g/mol. Its IUPAC name is (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone.

Molecular Properties

Compound Name(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone
PubChem CID43161777
Molecular FormulaC14H10Br2O2
Molecular Weight370.04 g/mol
Exact Mass367.90
IUPAC Name(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone
SMILESCOc1ccc(Br)cc1C(=O)c1cccc(Br)c1
InChIInChI=1S/C14H10Br2O2/c1-18-13-6-5-11(16)8-12(13)14(17)9-3-2-4-10(15)7-9/h2-8H,1H3
InChIKeyUJEQBDCVLKBSNY-UHFFFAOYSA-N
XLogP4.45
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.04
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-methoxyphenyl)-(2,6-dimethoxyphenyl)methanone
CID 43339938
[4-(aminomethyl)phenyl]-(5-bromo-2-methoxyphenyl)methanone
CID 116917510
(5-bromo-2-methoxyphenyl)-(4-ethoxyphenyl)methanone
CID 43339931
(5-bromo-2-methoxyphenyl)-(2-chlorophenyl)methanone
CID 43339911
(2,5-dibromophenyl)-(3,4-dimethoxyphenyl)methanone
CID 114368506
(5-bromo-2-ethoxyphenyl)-(3-chlorophenyl)methanone
CID 43311306
1-(5-bromo-2-methoxyphenyl)ethanone
CID 2757029
(3,5-dibromophenyl)-(2-methoxy-5-methylphenyl)methanone
CID 107976766
(5-bromo-2-ethoxyphenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 62919039
(5-fluoro-2-methoxyphenyl)-(3-fluorophenyl)methanone
CID 43339656
1-(5-bromo-2-methoxyphenyl)propane-1,2-dione
CID 82132285
5-bromo-2-methoxy-N'-methylbenzohydrazide
CID 116846857

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone?
The IUPAC name of (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone (CID 43161777) is (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone.
What is the SMILES notation for (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone?
The canonical SMILES for (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone is COc1ccc(Br)cc1C(=O)c1cccc(Br)c1.
What is the InChIKey of (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone?
The InChIKey is UJEQBDCVLKBSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2O2/c1-18-13-6-5-11(16)8-12(13)14(17)9-3-2-4-10(15)7-9/h2-8H,1H3.
What are the key properties of (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone?
(5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone has a molecular weight of 370.04 g/mol, XLogP of 4.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-methoxyphenyl)-(3-bromophenyl)methanone is sourced from PubChem (CID 43161777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).