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Basic information
- Standard SMILES
CCC(C)N(Cc1ccc(Cl)cc1)C(=O)Cl- InChIKey
NCLONAASFFVUIQ-UHFFFAOYSA-N- Molecular formula
- C12H15Cl2NO
- Average molar mass
- 260.16 g/mol
- Monoisotopic mass
- 259.0530695
Names & identifiers
- Preferred name
- N-[4-chlorobenzyl]-N-sec.-butyl-carbamoyl chloride
- IUPAC
- N-butan-2-yl-N-[(4-chlorophenyl)methyl]carbamoyl chloride
Names & synonyms
SCHEMBL11690432NCLONAASFFVUIQ-UHFFFAOYSA-NN-[4-chlorobenzyl]-N-sec.-butyl-carbamoyl chloride
Database identifiers
- PubChem CID
- 21452004
Properties
Computed structural propertiesFilling in
- XLogP
- 4.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Related reactions
2 records
Compound notes
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