Basic information
- CAS
60012-46-6- Standard SMILES
CCOC(=O)Nc1nc(Cl)c(Cl)nc1Cl- InChIKey
YWBBFBURBFCXTB-UHFFFAOYSA-N- Molecular formula
- C7H6Cl3N3O2
- Average molar mass
- 270.5 g/mol
- Monoisotopic mass
- 268.95256
Names & identifiers
- Preferred name
- Ethyl (3,5,6-trichloropyrazin-2-yl)carbamate
- IUPAC
- ethyl N-(3,5,6-trichloropyrazin-2-yl)carbamate
Names & synonyms
NSC22511860012-46-6ethyl N-(3,5,6-trichloropyrazin-2-yl)carbamateEthyl (3,5,6-trichloropyrazin-2-yl)carbamateDTXSID40310317NSC-225118Carbamic acid, (trichloropyrazinyl)-,ethyl ester
Database identifiers
- CAS
60012-46-6- PubChem CID
- 312904
- DTXSID
DTXSID40310317
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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