Basic information
- CAS
40374-14-9- Standard SMILES
CCC1(CC)Oc2cccc(OC(=O)N(C)C(C)=O)c2O1- InChIKey
NQQWCDMYWSQASG-UHFFFAOYSA-N- Molecular formula
- C15H19NO5
- Average molar mass
- 293.31 g/mol
- Monoisotopic mass
- 293.12632271
Names & identifiers
- Preferred name
- 2,2-Diethyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamate
- IUPAC
- (2,2-diethyl-1,3-benzodioxol-4-yl) N-acetyl-N-methylcarbamate
Names & synonyms
40374-14-9DTXSID109607822,2-Diethyl-2H-1,3-benzodioxol-4-yl acetyl(methyl)carbamateRefChem:1059091DTXCID701388626Acetylmethylcarbamic acid 2,2-diethyl-1,3-benzodioxol-4-yl esterCarbamic acid, acetylmethyl-, 2,2-diethyl-1,3-benzodioxol-4-yl ester
Database identifiers
- CAS
40374-14-9- PubChem CID
- 218201
- DTXSID
DTXSID10960782
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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