Basic information
- CAS
1180536-78-0- Standard SMILES
CC1C(C)N1C(=O)c1ccccc1- InChIKey
QKNFYUIJRJEEOM-UHFFFAOYSA-N- Molecular formula
- C11H13NO
- Average molar mass
- 175.23 g/mol
- Monoisotopic mass
- 175.09971404
Names & identifiers
- Preferred name
- (2,3-Dimethyl-1-aziridinyl)phenylmethanone
- IUPAC
- (2,3-dimethylaziridin-1-yl)-phenylmethanone
Names & synonyms
(2,3-Dimethyl-1-aziridinyl)phenylmethanone1180536-78-0RefChem:205454DTXSID201265190(2,3-Dimethylaziridin-1-yl)(phenyl)methanone
Database identifiers
- CAS
1180536-78-0- PubChem CID
- 135083804
- DTXSID
DTXSID201265190
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 20.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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