Basic information
- CAS
6334-61-8- Standard SMILES
O=C(NCCCl)OCCOC(=O)NCCCl- InChIKey
KZYQKQHHINQVSR-UHFFFAOYSA-N- Molecular formula
- C8H14Cl2N2O4
- Average molar mass
- 273.11 g/mol
- Monoisotopic mass
- 272.0330623
Names & identifiers
- Preferred name
- Ethane-1,2-diyl bis[(2-chloroethyl)carbamate]
- IUPAC
- 2-(2-chloroethylcarbamoyloxy)ethyl N-(2-chloroethyl)carbamate
Names & synonyms
ethane-1,2-diyl bis[(2-chloroethyl)carbamate]6334-61-82-(2-chloroethylcarbamoyloxy)ethyl N-(2-chloroethyl)carbamateNSC29229DTXSID60283039NSC-29229NSC526657NSC-526657
Database identifiers
- CAS
6334-61-8- PubChem CID
- 232160
- DTXSID
DTXSID60283039
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 194
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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