Methyl 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-[(phenylmethoxy)methyl]cyclobutanecarboxylate
Basic information
- CAS
191110-92-6- Standard SMILES
COC(=O)C1(NC(=O)OC(C)(C)C)CC(COCc2ccccc2)C1- InChIKey
RAYZFYRHFWLXQG-UHFFFAOYSA-N- Molecular formula
- C19H27NO5
- Average molar mass
- 349.4 g/mol
- Monoisotopic mass
- 349.18892296
Names & identifiers
- Preferred name
- Methyl 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-[(phenylmethoxy)methyl]cyclobutanecarboxylate
- IUPAC
- methyl 1-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxymethyl)cyclobutane-1-carboxylate
Names & synonyms
SCHEMBL7936536DTXSID001117834Methyl 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-[(phenylmethoxy)methyl]cyclobutanecarboxylate191110-92-6Methyl 3-[(benzyloxy)methyl]-1-[(tert-butoxycarbonyl)amino]cyclobutane-1-carboxylate
Database identifiers
- CAS
191110-92-6- PubChem CID
- 57020009
- DTXSID
DTXSID001117834
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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