2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-4,5-dimethyl-
Basic information
- CAS
104502-43-4- Standard SMILES
CC1=C(Cl)C(=O)OC1(C)CN(C)C- InChIKey
GVZNWFBCWCSSKC-UHFFFAOYSA-N- Molecular formula
- C9H14ClNO2
- Average molar mass
- 203.66 g/mol
- Monoisotopic mass
- 203.0713064
Names & identifiers
- Preferred name
- 2(5H)-Furanone, 3-chloro-5-((dimethylamino)methyl)-4,5-dimethyl-
- IUPAC
- 3-chloro-5-[(dimethylamino)methyl]-4,5-dimethylfuran-2-one
Names & synonyms
BRN 4676885104502-43-42(5H)-FURANONE, 3-CHLORO-5-((DIMETHYLAMINO)METHYL)-4,5-DIMETHYL-3-Chloro-2,5-dihydro-4,5-dimethyl-5-(dimethylaminomethyl)-2-furanoneRefChem:241767GVZNWFBCWCSSKC-UHFFFAOYSA-N3-Chloro-5-((dimethylamino)methyl)-4,5-dimethyl-2(5H)-furanone2-Chloro-3,4-dimethyl-4-dimethylaminomethyl-2-butenolide-43-chloro-5-[(dimethylamino)methyl]-4,5-dimethyl-2(5H)-furanone3-chloro-5-[(dimethylamino)methyl]-4,5-dimethylfuran-2-oneDTXSID90909013CCG-49041
Show more names
AE-641/30211008SR-01000638529-13-Chloro-5-[(dimethylamino)methyl]-4,5-dimethylfuran-2(5H)-one
Database identifiers
- CAS
104502-43-4- PubChem CID
- 59857
- DTXSID
DTXSID90909013- Nikkaji
- J599.917K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…