Basic information
- CAS
26028-36-4- Standard SMILES
COC(=O)c1cc2cc(Br)ccc2o1- InChIKey
ZZDBMDNRQQDSKG-UHFFFAOYSA-N- Molecular formula
- C10H7BrO3
- Average molar mass
- 255.06 g/mol
- Monoisotopic mass
- 253.95786
Names & identifiers
- Preferred name
- Methyl 5-bromo-1-benzofuran-2-carboxylate
- IUPAC
- methyl 5-bromo-1-benzofuran-2-carboxylate
- English name
- 5-BROMOBENZOFURAN-2-CARBOXYLIC ACID METHYL ESTER
- Molecular formula
- C10H7BrO3
- Molecular weight
- 255.06
Names & synonyms
Methyl 5-bromo-1-benzofuran-2-carboxylateRefChem:816909804-819-126028-36-4methyl 5-bromobenzofuran-2-carboxylate5-Bromobenzofuran-2-carboxylic acid methyl ester5-Bromo-benzofuran-2-carboxylic acid methyl ester2-BENZOFURANCARBOXYLIC ACID, 5-BROMO-, METHYL ESTERMFCD026256035-Bromo-2-benzofurancarboxylic Acid Methyl EsterMethyl 5-bromobenzo[b]furan-2-carboxylatemethyl 5-bromobenzo[d]furan-2-carboxylate
Show more names
Methyl5-bromobenzo[b]furan-2-carboxylate
SCHEMBL1066370SCHEMBL30474801DTXSID60347342BUTTPARK 34\07-75methyl5-bromobenzofuran-2-carboxylateSTK734237AKOS001739928FH-0731
Database identifiers
- CAS
26028-36-4- PubChem CID
- 620341
- DTXSID
DTXSID60347342- EC Number
- 804-819-1
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Boiling point
- 314.7 · 314.7±22.0 °C(Predicted)
- Density
- 1.589 · 1.589
- storage temp.
- 2 · 2-8°C
- Appearance
- White to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332
- Precautionary statements
- 260 · P260-P280-P312
- HS Code
- 2932990090 · 2932990090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302+H312+H332
- Precautionary statements
- P260-P280-P312
Chemistry & industry
Applications
Uses5-Bromobenzofuran-2-carboxylic acid methyl ester is used in the synthesis of biscationic, trypanocidal 1-benzofuran compounds.
Suppliers41 total
常州稀亚生物科技有限公司13775267187 · [email protected]
单县览铂生物科技有限公司15854067352 · [email protected]
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]
深圳法默科技有限公司0755-86648230 · [email protected]
南通博苏医药科技有限公司0513-51005092 15962844273 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Related reactions
1 records
Compound notes
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