Carbamic acid, dimethyl-, 6-iodo-7-quinolinyl ester
Basic information
- CAS
829666-48-0- Standard SMILES
CN(C)C(=O)Oc1cc2ncccc2cc1I- InChIKey
KIOJHMVZICLYIU-UHFFFAOYSA-N- Molecular formula
- C12H11IN2O2
- Average molar mass
- 342.13 g/mol
- Monoisotopic mass
- 341.98653
Names & identifiers
- Preferred name
- Carbamic acid, dimethyl-, 6-iodo-7-quinolinyl ester
- IUPAC
- (6-iodoquinolin-7-yl) N,N-dimethylcarbamate
Names & synonyms
829666-48-06-Iodoquinolin-7-yl dimethylcarbamateCarbamic acid, dimethyl-, 6-iodo-7-quinolinyl esterDTXSID50459983
Database identifiers
- CAS
829666-48-0- PubChem CID
- 11244769
- DTXSID
DTXSID50459983
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 286
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Compound notes
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