Basic information
- CAS
60166-83-8- Standard SMILES
COc1ccsc1C(=O)O- InChIKey
LSSMRBBQCHSDNS-UHFFFAOYSA-N- Molecular formula
- C6H6O3S
- Average molar mass
- 158.18 g/mol
- Monoisotopic mass
- 158.00376505
Names & identifiers
- Preferred name
- 3-Methoxythiophene-2-carboxylic acid
- IUPAC
- 3-methoxythiophene-2-carboxylic acid
- English name
- 3-Methoxythiophene-2-carboxylic acid
- Molecular formula
- C6H6O3S
- Molecular weight
- 158.18
Names & synonyms
3-methoxythiophene-2-carboxylic acid60166-83-8DTXSID10363279RefChem:280545DTXCID50314326844-807-3MFCD013166133-methoxy-2-thiophenecarboxylic acidBionet2_0005373-Methoxythiophene-2-carboxylicacidA1EFPSCHEMBL834652
Show more names
3-Methoxythiophene-2-carb2-Carboxy-3-methoxythiophene2-Thiophenecarboxylic acid, 3-methoxy-3-Methoxythiophene-2-carboxylic acid ISO 9001：2015 REACH
orb3030497SCHEMBL54322993-methoxy-2-thienylcarboxlic acid3-methoxythiophene carboxylic acidHMS1365I09Fr13787KCA16683SBB036127
Database identifiers
- CAS
60166-83-8- PubChem CID
- 1483475
- DTXSID
DTXSID10363279- EC Number
- 844-807-3
- Nikkaji
- J446.167C
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 137
Physicochemical properties
- Boiling point
- 295.7 · 295.7±20.0 °C(Predicted)
- Density
- 1.37 · 1.370±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- form
- Powder
- pka
- 3.66 · 3.66±0.10(Predicted)
- Appearance
- Light yellow to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi
- HS Code
- 2934999090 · 2934999090
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2934999090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers43 total
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海攀鸿化工科技有限公司021-56491756 13512199871 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
山东博洛达生物科技有限公司0531-68659041 · [email protected]
熵哲(兰州)生物医药科技有限公司18119421752 13919408782
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
上海默达医药科技有限公司+86 (0)21 51320687 51371369 1744605818
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Related reactions
38 records
Compound notes
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