2-Aziridinebutanol, 3,3-dimethyl-2-phenyl-
Basic information
- CAS
61686-95-1- Standard SMILES
CC1(C)NC1(CCCCO)c1ccccc1- InChIKey
MOKKKWNQLQFLHO-UHFFFAOYSA-N- Molecular formula
- C14H21NO
- Average molar mass
- 219.32 g/mol
- Monoisotopic mass
- 219.16231429
Names & identifiers
- Preferred name
- 2-Aziridinebutanol, 3,3-dimethyl-2-phenyl-
- IUPAC
- 4-(3,3-dimethyl-2-phenylaziridin-2-yl)butan-1-ol
Names & synonyms
2-Aziridinebutanol, 3,3-dimethyl-2-phenyl-61686-95-14-(3,3-dimethyl-2-phenylaziridin-2-yl)butan-1-olDTXSID50486173
Database identifiers
- CAS
61686-95-1- PubChem CID
- 12299232
- DTXSID
DTXSID50486173
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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