Basic information
- CAS
5273-61-0- Standard SMILES
O=C1C=CC(=O)C(Br)C1Br- InChIKey
YVPSGOKCNLXUJP-UHFFFAOYSA-N- Molecular formula
- C6H4Br2O2
- Average molar mass
- 267.9 g/mol
- Monoisotopic mass
- 265.8578
Names & identifiers
- Preferred name
- 5,6-Dibromocyclohex-2-ene-1,4-dione
- IUPAC
- 5,6-dibromocyclohex-2-ene-1,4-dione
- English name
- 5,6-dibromocyclohex-2-ene-1,4-dione
- Molecular formula
- C6H4Br2O2
- Molecular weight
- 267.9
Names & synonyms
5,6-dibromocyclohex-2-ene-1,4-dione5273-61-05,6-dibromo-2-cyclohexene-1,4-dioneMFCD01568777NSC1393482-Cyclohexene-1,4-dione,5,6-dibromo-SCHEMBL801296DTXSID20300857AKOS015992082NSC-139348DS-004041CS-0331872
Show more names
(5RS,6RS)-5,6-dibromocyclohex-2-ene-1,4-dione
C1592212N-719
Database identifiers
- CAS
5273-61-0- PubChem CID
- 283979
- DTXSID
DTXSID20300857
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Boiling point
- 312.2 · 312.2±42.0 °C(Predicted)
- Density
- 2.205 · 2.205±0.06 g/cm3(Predicted)
- HS Code
- 2914790090 · 2914790090
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
- hs_code
- 2914790090
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
上海昂提生物科技有限公司13764913901 · [email protected]
武汉爱默尔特科技有限公司027-888-4366503 13986279625 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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