Carbazic acid, 3,3-bis(2-chloroethyl)-, ethyl ester
Basic information
- CAS
77944-95-7- Standard SMILES
CCOC(=O)NN(CCCl)CCCl- InChIKey
SPENQMHGOSGLRT-UHFFFAOYSA-N- Molecular formula
- C7H14Cl2N2O2
- Average molar mass
- 229.1 g/mol
- Monoisotopic mass
- 228.0432331
Names & identifiers
- Preferred name
- Carbazic acid, 3,3-bis(2-chloroethyl)-, ethyl ester
- IUPAC
- ethyl N-[bis(2-chloroethyl)amino]carbamate
- English name
- ethyl N-[bis(2-chloroethyl)amino]carbamate
- Molecular formula
- C7H14Cl2N2O2
- Molecular weight
- 0
Names & synonyms
BRN 186827377944-95-7Ethyl 3,3-bis(2-chloroethyl)carbazate3,3-Bis(2-chloroethyl)carbazic acid ethyl esterCARBAZIC ACID, 3,3-BIS(2-CHLOROETHYL)-, ETHYL ESTER1-Ethoxycarbonyl-2,2-bis(2-chloroethyl)hydrazineDTXSID00228606N(sup 2),N(sup 2)-Bis(2-chloraethyl)-carbaethoxyhydrazid [German]N(sup 2),N(sup 2)-Bis(2-chloraethyl)-carbaethoxyhydrazidRefChem:333208DTXCID10151097Ethyl 2,2-bis(2-chloroethyl)hydrazine-1-carboxylate
Show more names
ethyl N-[bis(2-chloroethyl)amino]carbamate
Database identifiers
- CAS
77944-95-7- PubChem CID
- 53843
- DTXSID
DTXSID00228606- Nikkaji
- J69.465G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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