Basic information
- Standard SMILES
COc1ccc([N+](=O)[O-])c(N(C)C(=O)OC(C)(C)C)c1- InChIKey
XCHXJZVQGPHSIA-UHFFFAOYSA-N- Molecular formula
- C13H18N2O5
- Average molar mass
- 282.29 g/mol
Names & identifiers
- Preferred name
- N-t-butoxycarbonyl-N-methyl-5-methoxy-2-nitroaniline
- IUPAC
- tert-butyl N-(5-methoxy-2-nitrophenyl)-N-methylcarbamate
Names & synonyms
SCHEMBL1131379XCHXJZVQGPHSIA-UHFFFAOYSA-NAT54595N-t-butoxycarbonyl-N-methyl-5-methoxy-2-nitroanilineTERT-BUTYL (5-METHOXY-2-NITROPHENYL)(METHYL)CARBAMATEN-(5-methoxy-2-nitrophenyl)-N-methylcarbamic acid t-butyl ester185428-59-5
Database identifiers
- PubChem CID
- 15544600
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 361
Related reactions
13 records
Compound notes
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