Basic information
- CAS
6988-20-1- Standard SMILES
CNC(=O)Oc1ccccc1C1OCC(C)O1- InChIKey
XXIJPDVJRAQVSH-UHFFFAOYSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.10010796
Names & identifiers
- Preferred name
- Phenol, 2-(4-methyl-1,3-dioxolan-2-yl)-, 1-(N-methylcarbamate)
- IUPAC
- [2-(4-methyl-1,3-dioxolan-2-yl)phenyl] N-methylcarbamate
Names & synonyms
6988-20-1RefChem:1094824Phenol, 2-(4-methyl-1,3-dioxolan-2-yl)-, 1-(N-methylcarbamate)BRN 1318961o-(4-Methyl-1,3-dioxolan-2-yl)phenyl methylcarbamateAI3-27564AI 3-27564Carbamic acid, methyl-, o-(4-methyl-1,3-dioxolan-2-yl)phenyl esterSCHEMBL11450837DTXSID80990157Phenol, 2-(4-methyl-1,3-dioxolan-2-yl)-, methylcarbamate2-(4-Methyl-1,3-dioxolan-2-yl)phenyl hydrogen methylcarbonimidate
Database identifiers
- CAS
6988-20-1- PubChem CID
- 197862
- DTXSID
DTXSID80990157
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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