Basic information
- CAS
113763-37-4- Standard SMILES
COC(=O)c1c(O)cccc1Br- InChIKey
WIRCWLQPIBGDQH-UHFFFAOYSA-N- Molecular formula
- C8H7BrO3
- Average molar mass
- 231.04 g/mol
- Monoisotopic mass
- 229.95786
Names & identifiers
- Preferred name
- Methyl 2-bromo-6-hydroxybenzoate
- IUPAC
- methyl 2-bromo-6-hydroxybenzoate
- English name
- 2-Bromo-6-hydroxy-benzoic acid methyl ester
- Molecular formula
- C8H7BrO3
- Molecular weight
- 231.04
Names & synonyms
methyl 2-bromo-6-hydroxybenzoate113763-37-4Benzoic acid, 2-bromo-6-hydroxy-, methyl esterMFCD18398784SCHEMBL4144207methyl2-bromo-6-hydroxybenzoateDTXSID00602169WIRCWLQPIBGDQH-UHFFFAOYSA-Nmethyl 2-bromo-6-hydroxy-benzoateBS-19246SY355314DB-091669
Show more names
2-Bromo-6-hydroxy-benzoic acid methyl esterG90232F576431
Database identifiers
- CAS
113763-37-4- PubChem CID
- 20074464
- DTXSID
DTXSID00602169
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Boiling point
- 263.5 · 263.5±20.0 °C(Predicted)
- Density
- 1.627 · 1.627±0.06 g/cm3(Predicted)
- pka
- 8.79 · 8.79±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2916310090 · 2916310090
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
- 2916310090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers27 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安徽合诺生物科技有限公司0555-2761852
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
无锡探索者医药科技有限公司0510-0510-86396359 13382276200 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
安徽合诺生物科技有限公司18455579438
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
湖州清硫硅生物科技有限公司13626726938 · [email protected]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [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]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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