Basic information
- CAS
350989-87-6- Standard SMILES
COC(=O)c1c(N)sc(C)c1-c1ccc(OC)cc1- InChIKey
FAFLAZLGMWVSFQ-UHFFFAOYSA-N- Molecular formula
- C14H15NO3S
- Average molar mass
- 277.34 g/mol
- Monoisotopic mass
- 277.07726451
Names & identifiers
- Preferred name
- Methyl 2-amino-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate
- IUPAC
- methyl 2-amino-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate
- English name
- 2-Amino-4-(4-methoxy-phenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester
- Molecular formula
- C14H15NO3S
- Molecular weight
- 277.34
Names & synonyms
methyl 2-amino-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate350989-87-6DTXSID40358017RefChem:354036DTXCID30309073MFCD019222282-Amino-4-(4-methoxy-phenyl)-5-methyl-thiophene-3-carboxylic acid methyl ester2-amino-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylic acid methyl esterZINC00442789CBMicro_030510Oprea1_439725ALBB-001761
Show more names
IVK/9065131AK-968/13779339CHEMBRDG-BB 3000871Methyl 2-amino-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxyla2-amino-4-(4-methoxyphenyl)-5-methyl-3-thiophenecarboxylic acid methyl ester
BBL016341STK400519AKOS000220111VS-05282BIM-0030699.P001DB-028498CS-0279803H21680
Database identifiers
- CAS
350989-87-6
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers2 total
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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