(1-Tert-butoxycarbonylbut-3-enylamino)-cyclohexanecarboxylic acid
Basic information
- Standard SMILES
C=CCC(NC1(C(=O)O)CCCCC1)C(=O)OC(C)(C)C- InChIKey
UTUOOUGSSXVETH-UHFFFAOYSA-N- Molecular formula
- C16H27NO4
- Average molar mass
- 297.39 g/mol
Names & identifiers
- Preferred name
- (1-Tert-butoxycarbonylbut-3-enylamino)-cyclohexanecarboxylic acid
- IUPAC
- 1-[[1-[(2-methylpropan-2-yl)oxy]-1-oxopent-4-en-2-yl]amino]cyclohexane-1-carboxylic acid
Names & synonyms
SCHEMBL7417459UTUOOUGSSXVETH-UHFFFAOYSA-N(1-tert-butoxycarbonylbut-3-enylamino)-cyclohexanecarboxylic acid
Database identifiers
- PubChem CID
- 54371918
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 392
Related reactions
1 records
Compound notes
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