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Basic information
- CAS
65369-22-4- Standard SMILES
COC(=O)c1cscc1OC- InChIKey
LQIVVUILGDRRHE-UHFFFAOYSA-N- Molecular formula
- C7H8O3S
- Average molar mass
- 172.2 g/mol
- Monoisotopic mass
- 172.01941529
Names & identifiers
- Preferred name
- Methyl 4-methoxythiophene-3-carboxylate
- IUPAC
- methyl 4-methoxythiophene-3-carboxylate
- English name
- Methyl 4-methoxythiophene-3-carboxylate
- Molecular formula
- C7H8O3S
- Molecular weight
- 172.2
Names & synonyms
methyl 4-methoxythiophene-3-carboxylate65369-22-4DTXSID50380889RefChem:355773DTXCID70331914MFCD000679954-methoxy-thiophene-3-carboxylic acid methyl ester4-methoxy-3-thiophenecarboxylic acid methyl ester3-Thiophenecarboxylic acid, 4-methoxy-, methyl estermethyl 4-methoxy-3-thiophenecarboxylateMaybridge1_004625orb3169934
Show more names
Compound Fr12173Methyl 4-Methoxythiophene-3-arboxylateMETHYL 4-METHOXYTHIOPHENE-3-CARBOXYLATE ISO 9001：2015 REACH
SCHEMBL4008820SCHEMBL6766241SCHEMBL29189494HMS554K05CHEBI:194907LQIVVUILGDRRHE-UHFFFAOYSA-NFr12173SBB088656
Database identifiers
- CAS
65369-22-4- PubChem CID
- 2778377
- DTXSID
DTXSID50380889- ChEBI
CHEBI:194907
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 70 °C · 70 °C
- Boiling point
- 248.1 · 248.1±20.0 °C(Predicted)
- Density
- 1.222 · 1.222±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- crystalline powder
- color
- Gray / beige
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39-24/25
- 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.
Safety data
- hs_code
- 2934999090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39-24/25
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers18 total
Aladdin Scientific[email protected]
上海凯曼化工科技有限公司021-021-50400622 15618790390 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
上海卓因生物科技有限公司021-61317773 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海思言生物科技有限公司021-50908862，442785678，326799392 18721037013 · [email protected]
上海新平精细化学品有限公司18221735425 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
浙江联硕生物科技有限公司18616526224 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Additional notes
DefinitionChEBI: Methyl 4-methoxythiophene-3-carboxylate is a thiophenecarboxylic acid.
Related reactions
6 records
Compound notes
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