Basic information
- CAS
501082-56-0- Standard SMILES
COC(=O)c1cc(N)c(C)s1- InChIKey
ZTTXAKCLKGBDIR-UHFFFAOYSA-N- Molecular formula
- C7H9NO2S
- Average molar mass
- 171.22 g/mol
Names & identifiers
- Preferred name
- Methyl 4-amino-5-methylthiophene-2-carboxylate
- IUPAC
- methyl 4-amino-5-methylthiophene-2-carboxylate
- English name
- methyl4-amino-5-methylthiophene-2-carboxylate
- Molecular formula
- C7H9NO2S
- Molecular weight
- 171.22
Names & synonyms
methyl 4-amino-5-methylthiophene-2-carboxylate501082-56-0RefChem:816176852-114-2methyl4-amino-5-methylthiophene-2-carboxylateMFCD14694722SCHEMBL1417353ZTTXAKCLKGBDIR-UHFFFAOYSA-N2-Thiophenecarboxylic acid, 4-amino-5-methyl-, methyl esterBVA08256AKOS010564566s11695
Show more names
4-Amino-5-methylthiophene-2-carboxylic acid methyl ester
BS-28870DA-32509SY147539CS-0163329methyl4-amino-5-methylthiophene-2-carboxylatEN300-116908methyl 4-amino-5-methyl-thiophene-2-carboxylateF690779
Database identifiers
- CAS
501082-56-0- PubChem CID
- 59640747
- EC Number
- 852-114-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 332 · 332.0±37.0 °C(Predicted)
- Density
- 1.264 · 1.264±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 2.97 · 2.97±0.10(Predicted)
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319
- Precautionary statements
- 501 · P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330
- 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
H302 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2934999090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319
- Precautionary statements
- P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330
Chemistry & industry
Applications
UsesMethyl 4-amino-5-methylthiophene-2-carboxylate
Suppliers34 total
Henan Rane Chemical Co., Ltd.+86-18738066252 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [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]
成都添福瑞生物科技有限公司18030648795 18030648795 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
陕西宇鼎卓医药科技有限公司18992018580 18165105898 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
天津泛德科技发展有限公司15620920485; 15620920485 · [email protected]
许昌峰飞新材料科技有限公司19713077352; 19713077352 · [email protected]
Related reactions
17 records
Compound notes
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