Basic information
- CAS
774220-36-9- Standard SMILES
Brc1cccc2c1CCO2- InChIKey
FLJVEXCGBADRNM-UHFFFAOYSA-N- Molecular formula
- C8H7BrO
- Average molar mass
- 199.04 g/mol
- Monoisotopic mass
- 197.96803
Names & identifiers
- Preferred name
- 4-Bromo-2,3-dihydrobenzofuran
- IUPAC
- 4-bromo-2,3-dihydro-1-benzofuran
- English name
- 4-bromo-2,3-dihydrobenzofuran
- Molecular formula
- C8H7BrO
- Molecular weight
- 199.04
Names & synonyms
4-Bromo-2,3-dihydrobenzofuranRefChem:519115868-337-3774220-36-94-Bromo-2,3-dihydro-1-benzofuran4-BROMO-2,3-DIHYDRO-BENZOFURANMFCD09880294Benzofuran, 4-bromo-2,3-dihydro-SCHEMBL2829908DTXSID80693611FLJVEXCGBADRNM-UHFFFAOYSA-NAKOS006311115
Show more names
SB38710AS-47193SY021968DB-075319CS-0159358EN300-119203F12556F401802
Database identifiers
- CAS
774220-36-9- PubChem CID
- 53350366
- DTXSID
DTXSID80693611- EC Number
- 868-337-3
- Nikkaji
- J2.597.549I
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 126
Physicochemical properties
- Boiling point
- 135 °C · 135 °C(Press: 20 Torr)
- Density
- 1.436 g/cm3 · 1.436 g/cm3
- storage temp.
- 2 · 2-8°C
- Appearance
- Colorless to light yellow Solid-Liquid Mixture
- InChI
- InChI=1S/C8H7BrO/c9-7-2-1-3-8-6(7)4-5-10-8/h1-3H,4-5H2
- InChIKey
- FLJVEXCGBADRNM-UHFFFAOYSA-N
- SMILES
- O1C2=CC=CC(Br)=C2CC1
- 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.
GHS classification
GHS Classification
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesAs Benzofuran derivative, 4-bromo-2,3-dihydrobenzofuran can be used in the synthesis of melatonin receptor agonist and sodium hydrogen exchange compounds.
Suppliers37 total
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
上海爱孜康医药研究有限公司18721109360 · [email protected]
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
上海启智医药科技有限公司021-54849683 13601642561 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
上海偕腾生物科技有限公司+86-021-58975553 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…