Basic information
- CAS
648412-53-7- Standard SMILES
COC(=O)c1sc(Br)c(Br)c1C- InChIKey
WQCQDITXZPVXGB-UHFFFAOYSA-N- Molecular formula
- C7H6Br2O2S
- Average molar mass
- 314 g/mol
- Monoisotopic mass
- 311.84553
Names & identifiers
- Preferred name
- Methyl 4,5-dibromo-3-methylthiophene-2-carboxylate
- IUPAC
- methyl 4,5-dibromo-3-methylthiophene-2-carboxylate
- English name
- 4,5-Dibromo-3-methyl-thiophene-2-carboxylic acid methyl ester
- Molecular formula
- C7H6Br2O2S
- Molecular weight
- 313.99
Names & synonyms
648412-53-7Methyl 4,5-dibromo-3-methylthiophene-2-carboxylateMETHYL 4,5-DIBROMO-3-METHYL-THIOPHENE-2-CARBOXYLATE4,5-Dibromo-3-methyl-thiophene-2-carboxylic acid methyl esterMFCD11501085Methyl4,5-dibromo-3-methylthiophene-2-carboxylateSCHEMBL1973056DTXSID80695150WQCQDITXZPVXGB-UHFFFAOYSA-NAKOS015998825AS-36062DA-18352
Show more names
2-Thiophenecarboxylic acid, 4,5-dibromo-3-methyl-, methyl ester
CS-0172054F213286
Database identifiers
- CAS
648412-53-7- PubChem CID
- 53403241
- DTXSID
DTXSID80695150
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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
- P261-P305+P351+P338
Chemistry & industry
Suppliers18 total
成都市久鼎化学技术有限公司18584079237 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
常州宣叶科技有限公司15195022192 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
成都赛诺宁科技有限公司28-87999436 02887999436 · [email protected]
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
江阴瑞生化学有限公司13003356808 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
成都爱斯特化学技术有限公司15928766785 15928766785 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
苏州越恒医药科技有限公司15962211760 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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