Phenylmethyl N-((1S,2S)-2,3-dihydroxy-1-methylpropyl)carbamate
Basic information
- CAS
172097-45-9- Standard SMILES
C[C@H](NC(=O)OCc1ccccc1)[C@H](O)CO- InChIKey
LHBIWASMODZGRD-GXSJLCMTSA-N- Molecular formula
- C12H17NO4
- Average molar mass
- 239.27 g/mol
- Monoisotopic mass
- 239.11575802
Names & identifiers
- Preferred name
- Phenylmethyl N-((1S,2S)-2,3-dihydroxy-1-methylpropyl)carbamate
- IUPAC
- benzyl N-[(2S,3S)-3,4-dihydroxybutan-2-yl]carbamate
Names & synonyms
Phenylmethyl N-[(1S,2S)-2,3-dihydroxy-1-methylpropyl]carbamate172097-45-9Phenylmethyl N-((1S,2S)-2,3-dihydroxy-1-methylpropyl)carbamateRefChem:369918DTXSID501177528Benzyl [(2S,3S)-3,4-dihydroxybutan-2-yl]carbamate
Database identifiers
- CAS
172097-45-9- PubChem CID
- 165352001
- DTXSID
DTXSID501177528
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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