Basic information
- CAS
885271-13-6- Standard SMILES
COc1cc(Br)cc2c1OCC(C(=O)O)=C2- InChIKey
GTZCNRUHQQHSRC-UHFFFAOYSA-N- Molecular formula
- C11H9BrO4
- Average molar mass
- 285.09 g/mol
- Monoisotopic mass
- 283.96842
Names & identifiers
- Preferred name
- 6-bromo-8-methoxy-2H-chromene-3-carboxylic acid
- IUPAC
- 6-bromo-8-methoxy-2H-chromene-3-carboxylic acid
- English name
- 6-BROMO-8-METHOXY-2H-CHROMENE-3-CARBOXYLIC ACID
- Molecular formula
- C11H9BrO4
- Molecular weight
- 285.09
Names & synonyms
6-bromo-8-methoxy-2H-chromene-3-carboxylic acid885271-13-66-Bromo-8-methoxy-2H-1-benzopyran-3-carboxylic acidMFCD04114594DTXSID30585512AKOS024260611AB18637AS-47482DB-077369CS-0341888EN300-86786F13892
Show more names
2H-1-Benzopyran-3-carboxylic acid, 6-bromo-8-methoxy-
F4573296-BROMO-8-METHOXY-2H-CHROMENE-3-CARBOXYLICACID
Database identifiers
- CAS
885271-13-6- PubChem CID
- 16228337
- DTXSID
DTXSID30585512
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 315
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-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-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers7 total
上海爱孜康医药研究有限公司18721109360 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海威芬奇医药科技有限公司13817485796 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海智乾生物科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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