(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone

C14H9Cl3O2 — CID 86028415

IUPAC(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H9Cl3O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3
InChIKeyVAASLQUUYMTSPX-UHFFFAOYSA-N
MW315.58 g/mol
LogP4.89
Rot. Bonds3

About (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone

(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone (PubChem CID 86028415) has the molecular formula C14H9Cl3O2 and a molecular weight of 315.58 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
PubChem CID86028415
Molecular FormulaC14H9Cl3O2
Molecular Weight315.58 g/mol
Exact Mass313.97
IUPAC Name(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone
SMILESCOc1ccc(Cl)cc1C(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H9Cl3O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3
InChIKeyVAASLQUUYMTSPX-UHFFFAOYSA-N
XLogP4.89
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.58
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 112694005
(5-chloro-2-methoxyphenyl)-(2,4-dichlorophenyl)methanone
CID 63492522
(5-chloro-2-methoxyphenyl)-(2,3-difluorophenyl)methanone
CID 113425387
(2,3-dichlorophenyl)-(2,6-dimethoxyphenyl)methanone
CID 114970477
(5-chloro-2-methoxyphenyl)-(2-iodo-3-methylphenyl)methanone
CID 114029899
2-(5-chloro-2-methoxyphenyl)-1-(2,3-dichlorophenyl)ethanone
CID 114968572
(2-tert-butylphenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 104544982
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanone
CID 43339633
(5-chloro-2-methoxyphenyl)-(2-ethoxyphenyl)methanone
CID 79020316
(7-chloro-1-benzofuran-2-yl)-(5-chloro-2-methoxyphenyl)methanone
CID 115810745
1-benzothiophen-7-yl-(5-chloro-2-methoxyphenyl)methanone
CID 115791072
(3-chloro-4-methoxyphenyl)-(5-chloro-2-methoxyphenyl)methanone
CID 43161713

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone (CID 86028415) is (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone is COc1ccc(Cl)cc1C(=O)c1cccc(Cl)c1Cl.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone?
The InChIKey is VAASLQUUYMTSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl3O2/c1-19-12-6-5-8(15)7-10(12)14(18)9-3-2-4-11(16)13(9)17/h2-7H,1H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone?
(5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone has a molecular weight of 315.58 g/mol, XLogP of 4.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(2,3-dichlorophenyl)methanone is sourced from PubChem (CID 86028415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).