Basic information
- Standard SMILES
COC(=O)c1c(O)cccc1OCCCCNC(=O)OC(C)(C)C- InChIKey
JUFYUCBEBZVTME-UHFFFAOYSA-N- Molecular formula
- C17H25NO6
- Average molar mass
- 339.4 g/mol
Names & identifiers
- Preferred name
- Methyl 2-{4-[(tert-butoxycarbonyl)amino]butoxy}-6-hydroxybenzoate
- IUPAC
- methyl 2-hydroxy-6-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butoxy]benzoate
Names & synonyms
methyl 2-{4-[(tert-butoxycarbonyl)amino]butoxy}-6-hydroxybenzoateSCHEMBL2892290JUFYUCBEBZVTME-UHFFFAOYSA-N436864-52-7DB-3432392-(4-tert-butoxycarbonylamino-butoxy)-6-hydroxy-benzoic acid methyl ester2-(4-tert-Butoxycarbonylaminobutoxy)-6-hydroxybenzoic acid methyl ester
Database identifiers
- PubChem CID
- 10980693
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 406
Related reactions
9 records
Compound notes
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