Basic information
- CAS
626-37-9- Standard SMILES
CCOC(=O)N[N+](=O)[O-]- InChIKey
YSJKYAHYBFJVKV-UHFFFAOYSA-N- Molecular formula
- C3H6N2O4
- Average molar mass
- 134.09 g/mol
- Monoisotopic mass
- 134.03275668
Names & identifiers
- Preferred name
- Ethyl N-nitrocarbamate
- IUPAC
- ethyl N-nitrocarbamate
Names & synonyms
Ethyl N-nitrocarbamate626-37-9ethyl nitrocarbamateNitrourethanSCHEMBL4196098DTXSID70275460YSJKYAHYBFJVKV-UHFFFAOYSA-NNSC36206NSC-36206AKOS040768798
Database identifiers
- CAS
626-37-9- PubChem CID
- 43970
- DTXSID
DTXSID70275460- Nikkaji
- J1.691H
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 117
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
1 records
Compound notes
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