Basic information
- CAS
100700-18-3- Standard SMILES
CCC(C(N)=O)[NH+](CCCl)CCCl.[Cl-]- InChIKey
WLDDAMAQNUDKSY-UHFFFAOYSA-N- Molecular formula
- C8H17Cl3N2O
- Average molar mass
- 263.6 g/mol
- Monoisotopic mass
- 262.040646
Names & identifiers
- Preferred name
- Butyramide, 2-(bis(2-chloroethyl)amino)-, monohydrochloride
- IUPAC
- (1-amino-1-oxobutan-2-yl)-bis(2-chloroethyl)azanium chloride
Names & synonyms
2-(Bis(2-chloroethyl)amino)butyramide monohydrochloride100700-18-3BUTYRAMIDE, 2-(BIS(2-CHLOROETHYL)AMINO)-, MONOHYDROCHLORIDERefChem:331140
Database identifiers
- CAS
100700-18-3- PubChem CID
- 57962
Properties
Computed structural properties
- Topological polar surface area
- 47.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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