Basic information
- CAS
1889-99-2- Standard SMILES
CC1(C)C(=O)C(O)=C(Br)C1(C)C- InChIKey
ZAUGLWIVUJBQBG-UHFFFAOYSA-N- Molecular formula
- C9H13BrO2
- Average molar mass
- 233.1 g/mol
- Monoisotopic mass
- 232.00989
Names & identifiers
- Preferred name
- 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-
- IUPAC
- 3-bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-one
- English name
- 3-bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-one
- Molecular formula
- C9H13BrO2
- Molecular weight
- 233.10232
Names & synonyms
1889-99-2EINECS 217-570-32-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopenten-3-oneDTXSID10620453-Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-enoneRefChem:470972DTXCID90359693-Bromo-2-hydroxy-4,4,5,5-tetramethylcyclopent-2-en-1-oneZAUGLWIVUJBQBG-UHFFFAOYSA-NSCHEMBL11413983NS00026186
Show more names
3-Bromo-2-hydroxy-4,4,5,5-tetramethyl-2-cyclopenten-1-one
Database identifiers
- CAS
1889-99-2- PubChem CID
- 74683
- DTXSID
DTXSID1062045- EC Number
- 217-570-3
- Nikkaji
- J199.714I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl- (1889-99-2)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Cyclopenten-1-one, 3-bromo-2-hydroxy-4,4,5,5-tetramethyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers1 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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