N(1),N(6)-Bis(3-chloro-2-methylphenyl)hexanediamide
Basic information
- CAS
316139-04-5- Standard SMILES
Cc1c(Cl)cccc1NC(=O)CCCCC(=O)Nc1cccc(Cl)c1C- InChIKey
GROAXFNJDXAKDX-UHFFFAOYSA-N- Molecular formula
- C20H22Cl2N2O2
- Average molar mass
- 393.3 g/mol
- Monoisotopic mass
- 392.1058333
Names & identifiers
- Preferred name
- N(1),N(6)-Bis(3-chloro-2-methylphenyl)hexanediamide
- IUPAC
- N,N'-bis(3-chloro-2-methylphenyl)hexanediamide
- English name
- N,N'-bis(3-chloro-2-methylphenyl)hexanediamide
- Molecular formula
- C20H22Cl2N2O2
- Molecular weight
- 393.30688
Names & synonyms
N(1),N(6)-BIS(3-CHLORO-2-METHYLPHENYL)HEXANEDIAMIDERefChem:821348316139-04-5664-656-5AKOS003408355N,N'-bis(3-chloro-2-methylphenyl)hexanediamide
Database identifiers
- CAS
316139-04-5- PubChem CID
- 4050802
- EC Number
- 664-656-5
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 433
Physicochemical properties
- Hazard statements
- 413 · H413
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- Hazard statements
- H413
Suppliers
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Related reactions
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Compound notes
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