Methyl 2-[(3-hydroxyphenyl)methyl-methoxycarbonylamino]acetate
Basic information
- CAS
1000998-60-6- Standard SMILES
COC(=O)CN(Cc1cccc(O)c1)C(=O)OC- InChIKey
RYVGAFUMFMFSKQ-UHFFFAOYSA-N- Molecular formula
- C12H15NO5
- Average molar mass
- 253.25 g/mol
- Monoisotopic mass
- 253.09502258
Names & identifiers
- Preferred name
- Methyl 2-[(3-hydroxyphenyl)methyl-methoxycarbonylamino]acetate
- IUPAC
- methyl 2-[(3-hydroxyphenyl)methyl-methoxycarbonylamino]acetate
Names & synonyms
1000998-60-6SCHEMBL3082278DTXSID801163443Methyl N-[(3-hydroxyphenyl)methyl]-N-(methoxycarbonyl)glycinateN-[(3-Hydroxyphenyl)methyl]-N-(methoxycarbonyl)glycine methyl ester
Database identifiers
- CAS
1000998-60-6- PubChem CID
- 46197892
- DTXSID
DTXSID801163443
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 76.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 294
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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