Basic information
- CAS
206559-61-7- Standard SMILES
CCOc1cccc2cc(C(=O)O)oc12- InChIKey
DQJVZIUEXPTEKX-UHFFFAOYSA-N- Molecular formula
- C11H10O4
- Average molar mass
- 206.19 g/mol
- Monoisotopic mass
- 206.0579088
Names & identifiers
- Preferred name
- 7-Ethoxybenzofuran-2-carboxylic acid
- IUPAC
- 7-ethoxy-1-benzofuran-2-carboxylic acid
- English name
- 7-Ethoxybenzofuran-2-carboxylic acid
- Molecular formula
- C11H10O4
- Molecular weight
- 206.19
Names & synonyms
7-ETHOXYBENZOFURAN-2-CARBOXYLIC ACID206559-61-77-ethoxy-1-benzofuran-2-carboxylic acid2-Benzofurancarboxylic acid, 7-ethoxy-7-ethoxybenzo[b]furan-2-carboxylic acidMFCD00060710SCHEMBL2649753DTXSID80352958DQJVZIUEXPTEKX-UHFFFAOYSA-NGIA55961SBB005455STK320350
Show more names
TIMTEC-BB SBB0054557-ethoxy-2-benzofurancarboxylate7-Ethoxybenzofuran-2-carboxylic acid,98%2-Benzofurancarboxylicacid,7-ethoxy-(9CI)7-ETHOXYBENZO[B]FURAN-2-CARBOXYLIC ACID, 97%
AKOS000103500VS-0328ST057598DB-005401EN300-265728F018660F2145-1017
Database identifiers
- CAS
206559-61-7- PubChem CID
- 736202
- DTXSID
DTXSID80352958- EC Number
- 674-203-3
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Melting point
- 195 · 195-199 °C
- Boiling point
- 361.4 · 361.4±22.0 °C(Predicted)
- Density
- 1.293 · 1.293±0.06 g/cm3(Predicted)
- pka
- 3.06 · 3.06±0.30(Predicted)
- form
- Powder
- color
- Off-white
- CAS DataBase Reference
- 206559 · 206559-61-7(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi
- Safety Statements
- 24 · 24/25
- HazardClass
- IRRITANT
- HS Code
- 29329900 · 29329900
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 (28.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (28.6%)
Safety data
- hs_code
- 29329900
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 24/25
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Suppliers24 total
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
HONG KONG IPURE BIOLOGY CO.,LIMITED86 18062405514 18062405514 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海奈亦斯生物科技有限公司18321139117 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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