Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 2-propynyl ester, L-
Basic information
- CAS
73680-52-1- Standard SMILES
C#CCOC(=O)C(NC(=O)OCc1ccccc1)C(C)C- InChIKey
AHVKUWXEUVEHIV-AWEZNQCLSA-N- Molecular formula
- C16H19NO4
- Average molar mass
- 289.33 g/mol
- Monoisotopic mass
- 289.13140809
Names & identifiers
- Preferred name
- Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 2-propynyl ester, L-
- IUPAC
- prop-2-ynyl 3-methyl-2-(phenylmethoxycarbonylamino)butanoate
- English name
- N-(Benzyloxycarbonyl)-L-valine 2-propynyl ester
- Molecular weight
- 0
Names & synonyms
L-N-Benzyloxycarbonyl-3,3-dimethylalanine 2-propynyl esterALANINE, N-BENZYLOXYCARBONYL-3,3-DIMETHYL-, 2-PROPYNYL ESTER, L-73680-52-1RefChem:318016DTXSID10994507Prop-2-yn-1-yl N-[(benzyloxy)(hydroxy)methylidene]valinateN-(Benzyloxycarbonyl)-L-valine 2-propynyl ester
Database identifiers
- CAS
73680-52-1- PubChem CID
- 52106
- DTXSID
DTXSID10994507
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 390
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Related reactions
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Compound notes
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