2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene

C15H10Cl4O — CID 165362713

IUPAC2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene
SMILESCOc1ccc(C(=C(Cl)Cl)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C15H10Cl4O/c1-20-11-6-7-12(13(17)8-11)14(15(18)19)9-2-4-10(16)5-3-9/h2-8H,1H3
InChIKeyRQDIXLRPAYFMBN-UHFFFAOYSA-N
MW348.06 g/mol
LogP6.20
Rot. Bonds3

About 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene

2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene (PubChem CID 165362713) has the molecular formula C15H10Cl4O and a molecular weight of 348.06 g/mol. Its IUPAC name is 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene.

Molecular Properties

Compound Name2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene
PubChem CID165362713
Molecular FormulaC15H10Cl4O
Molecular Weight348.06 g/mol
Exact Mass345.95
IUPAC Name2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene
SMILESCOc1ccc(C(=C(Cl)Cl)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C15H10Cl4O/c1-20-11-6-7-12(13(17)8-11)14(15(18)19)9-2-4-10(16)5-3-9/h2-8H,1H3
InChIKeyRQDIXLRPAYFMBN-UHFFFAOYSA-N
XLogP6.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.06
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-4-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanone
CID 63210027
(4-chlorophenyl)-(2-fluoro-4-methoxyphenyl)methanone
CID 22475222
(5-chloro-2-fluorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 43561677
(2-bromo-4-chlorophenyl)-(2-chloro-4-methoxyphenyl)methanone
CID 107987161
(2-chloro-4-methoxyphenyl)-(3-chloro-4-methylphenyl)methanone
CID 55196391
4-[(2-chloro-4-methoxybenzoyl)amino]-3-hydroxybenzoic acid
CID 58230869
2-chloro-4-methoxy-N-methylbenzenecarbothioamide
CID 116827702
(1E)-2-chloro-N-hydroxy-5-methoxybenzenecarboximidoyl chloride
CID 88769229
S-(4-chlorobenzoyl)sulfanyl 4-methoxybenzenecarbothioate
CID 12596573
1-(2-chloro-4-methoxyphenyl)-2-methyl-2-(methylamino)propan-1-one
CID 116918735
N-[2-(4-chlorobenzoyl)-5-methoxyphenyl]-2,2-dimethylpropanamide
CID 135058493
4-methoxy-2-methyl-1-[1,2,2-tris(4-methoxy-2-methylphenyl)ethenyl]benzene
CID 102177256

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene?
The IUPAC name of 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene (CID 165362713) is 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene.
What is the SMILES notation for 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene?
The canonical SMILES for 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene is COc1ccc(C(=C(Cl)Cl)c2ccc(Cl)cc2)c(Cl)c1.
What is the InChIKey of 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene?
The InChIKey is RQDIXLRPAYFMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl4O/c1-20-11-6-7-12(13(17)8-11)14(15(18)19)9-2-4-10(16)5-3-9/h2-8H,1H3.
What are the key properties of 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene?
2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene has a molecular weight of 348.06 g/mol, XLogP of 6.20, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]-4-methoxybenzene is sourced from PubChem (CID 165362713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).