[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
Basic information
- CAS
19961-80-9- Standard SMILES
CNC(=O)Oc1cccc(NC(=O)OC(C)(C)C)c1- InChIKey
SOHPSFVASBQPBN-UHFFFAOYSA-N- Molecular formula
- C13H18N2O4
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.12665706
Names & identifiers
- Preferred name
- [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
- IUPAC
- [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamate
Names & synonyms
19961-80-9NSC222584[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-methylcarbamateDTXSID50310146NSC-2225843-[(tert-Butoxycarbonyl)amino]phenyl methylcarbamate
Database identifiers
- CAS
19961-80-9- PubChem CID
- 312484
- DTXSID
DTXSID50310146
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
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Compound notes
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