Basic information
- CAS
18315-57-6- Standard SMILES
CNC(=O)Oc1ccccc1OC(=O)NC- InChIKey
ZMXFHFXBXBQKOI-UHFFFAOYSA-N- Molecular formula
- C10H12N2O4
- Average molar mass
- 224.21 g/mol
- Monoisotopic mass
- 224.07970687
Names & identifiers
- Preferred name
- Pyrocatechol bis(methylcarbamate)
- IUPAC
- [2-(methylcarbamoyloxy)phenyl] N-methylcarbamate
Names & synonyms
18315-57-6CARBAMIC ACID, METHYL-, o-PHENYLENE ESTERMethylcarbamic acid o-phenylene ester1,2-Benzenediol, bis(methylcarbamate)L08MTK7ZOMNSC 32689Benzene, 1,2-bis(methylcarbamyloxy)-TL-1015BRN 1983581Pyrocatechol bis(methylcarbamate)UNII-L08MTK7ZOMNSC-32689
Show more names
DTXSID501713951,2-BENZENEDIOL, 1,2-BIS(N-METHYLCARBAMATE)RefChem:202793DTXCID10938861,2-Phenylene bis(methylcarbamate)NSC32689
Database identifiers
- CAS
18315-57-6- PubChem CID
- 29028
- DTXSID
DTXSID50171395- UNII
- L08MTK7ZOM
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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