2H-Azepin-2-one, 3-allylhexahydro-
Basic information
- CAS
29559-34-0- Standard SMILES
C=CCC1CCCCNC1=O- InChIKey
MZSNVCNQHZGYOY-UHFFFAOYSA-N- Molecular formula
- C9H15NO
- Average molar mass
- 153.22 g/mol
- Monoisotopic mass
- 153.1153641
Names & identifiers
- Preferred name
- 2H-Azepin-2-one, 3-allylhexahydro-
- IUPAC
- 3-prop-2-enylazepan-2-one
- English name
- Hexahydro-3-(2-propenyl)-2H-azepin-2-one
- Molecular formula
- C9H15NO
- Molecular weight
- 0
Names & synonyms
29559-34-02H-Azepin-2-one, 3-allylhexahydro-allylcaprolactamHEXAHYDRO-3-(2-PROPENYL)-2H-AZEPIN-2-ONE3-Allyl-2-azepanone #2H-Azepin-2-one, hexahydro-3-(2-propenyl)-SCHEMBL5182489DTXSID60952051MZSNVCNQHZGYOY-UHFFFAOYSA-N6-(Prop-2-en-1-yl)-3,4,5,6-tetrahydro-2H-azepin-7-olhexahydro-3-(2-propen-1-yl)-2H-azepin-2-one
Database identifiers
- CAS
29559-34-0- PubChem CID
- 34631
- DTXSID
DTXSID60952051- Nikkaji
- J100.072A
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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