Basic information
- CAS
59009-70-0- Standard SMILES
O=C1C2CN(Cc3ccccc3)CC1CN(Cc1ccccc1)C2- InChIKey
VDPCIZXWEQHOJC-UHFFFAOYSA-N- Molecular formula
- C21H24N2O
- Average molar mass
- 320.4 g/mol
- Monoisotopic mass
- 320.18886339
Names & identifiers
- Preferred name
- 3,7-Dibenzyl-3,7-diazabicyclo[3.3.1]nonan-9-one
- IUPAC
- 3,7-dibenzyl-3,7-diazabicyclo[3.3.1]nonan-9-one
- English name
- 3,7-Dibenzyl-3,7-diazabicyclo[3.3.1]nonan-9-one
- Molecular formula
- C21H24N2O
- Molecular weight
- 320.43
Names & synonyms
3,7-Dibenzyl-3,7-diazabicyclo[3.3.1]nonan-9-one59009-70-0NSC636666MFCD00795087Oprea1_0200893,7-dibenzyl-3,7-diazabicyclo[3.3.1]nonane-9-oneSCHEMBL2962712DTXSID50327178VDPCIZXWEQHOJC-UHFFFAOYSA-NAKOS005088183AKOS040765798NSC-636666
Show more names
DIBENZYLBISPIDONE3,7-Diazabicyclo[3.3.1]nonan-9-one, 3,7-bis(phenylmethyl)-
DB-3149163J-901N,N'-dibenzyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Database identifiers
- CAS
59009-70-0- PubChem CID
- 367172
- DTXSID
DTXSID50327178- Nikkaji
- J1.251.975C、J574.184J
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 376
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers4 total
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
南京合巨药业有限公司25-57027686 17372956142 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
Related reactions
18 records
Compound notes
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