2-chloro-6-(2,4,6-trichlorophenyl)benzamide

C13H7Cl4NO — CID 134622766

IUPAC2-chloro-6-(2,4,6-trichlorophenyl)benzamide
SMILESNC(=O)c1c(Cl)cccc1-c1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C13H7Cl4NO/c14-6-4-9(16)11(10(17)5-6)7-2-1-3-8(15)12(7)13(18)19/h1-5H,(H2,18,19)
InChIKeyBHVXWYKSQUBLFS-UHFFFAOYSA-N
MW335.02 g/mol
LogP5.07
Rot. Bonds2

About 2-chloro-6-(2,4,6-trichlorophenyl)benzamide

2-chloro-6-(2,4,6-trichlorophenyl)benzamide (PubChem CID 134622766) has the molecular formula C13H7Cl4NO and a molecular weight of 335.02 g/mol. Its IUPAC name is 2-chloro-6-(2,4,6-trichlorophenyl)benzamide.

Molecular Properties

Compound Name2-chloro-6-(2,4,6-trichlorophenyl)benzamide
PubChem CID134622766
Molecular FormulaC13H7Cl4NO
Molecular Weight335.02 g/mol
Exact Mass332.93
IUPAC Name2-chloro-6-(2,4,6-trichlorophenyl)benzamide
SMILESNC(=O)c1c(Cl)cccc1-c1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C13H7Cl4NO/c14-6-4-9(16)11(10(17)5-6)7-2-1-3-8(15)12(7)13(18)19/h1-5H,(H2,18,19)
InChIKeyBHVXWYKSQUBLFS-UHFFFAOYSA-N
XLogP5.07
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.02
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-6-(2,3,6-trichlorophenyl)benzamide
CID 134622714
2,6-dichlorobenzamide;hydrochloride
CID 172775002
3-chloro-2-(2,4,6-trichlorophenyl)benzamide
CID 134630611
2-(2,6-dichlorophenyl)benzamide
CID 67032434
2-chloro-6-[4-(trifluoromethyl)phenyl]benzamide
CID 134626188
2-[2-chloro-6-(2,4,6-trichlorophenyl)phenyl]acetic acid
CID 134622761
2-chloro-6-(methylamino)benzamide
CID 58906344
1,3,5-trichloro-2-[3-chloro-2-(chloromethyl)phenyl]benzene
CID 134617206
2-chloro-6-(2-chlorophenyl)benzoic acid
CID 53225809
6-chloro-4-(2-chlorophenyl)-2-methylquinoline-3-carboxamide
CID 8966744
4-chloro-2,6-difluorobenzamide
CID 22478130
2,4-dichloro-6-methoxybenzamide
CID 118588801

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2,4,6-trichlorophenyl)benzamide?
The IUPAC name of 2-chloro-6-(2,4,6-trichlorophenyl)benzamide (CID 134622766) is 2-chloro-6-(2,4,6-trichlorophenyl)benzamide.
What is the SMILES notation for 2-chloro-6-(2,4,6-trichlorophenyl)benzamide?
The canonical SMILES for 2-chloro-6-(2,4,6-trichlorophenyl)benzamide is NC(=O)c1c(Cl)cccc1-c1c(Cl)cc(Cl)cc1Cl.
What is the InChIKey of 2-chloro-6-(2,4,6-trichlorophenyl)benzamide?
The InChIKey is BHVXWYKSQUBLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl4NO/c14-6-4-9(16)11(10(17)5-6)7-2-1-3-8(15)12(7)13(18)19/h1-5H,(H2,18,19).
What are the key properties of 2-chloro-6-(2,4,6-trichlorophenyl)benzamide?
2-chloro-6-(2,4,6-trichlorophenyl)benzamide has a molecular weight of 335.02 g/mol, XLogP of 5.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2,4,6-trichlorophenyl)benzamide is sourced from PubChem (CID 134622766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).