Basic information
- CAS
478239-03-1- Standard SMILES
COC(=O)c1cc2sc(C)cc2[nH]1- InChIKey
AGEYHRRXKZBQTG-UHFFFAOYSA-N- Molecular formula
- C9H9NO2S
- Average molar mass
- 195.24 g/mol
- Monoisotopic mass
- 195.0353997
Names & identifiers
- Preferred name
- methyl 2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
- IUPAC
- methyl 2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
- English name
- Methyl 2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate
- Molecular formula
- C9H9NO2S
- Molecular weight
- 195.24
Names & synonyms
methyl 2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate478239-03-1methyl 2-methyl-4H-thieno(3,2-b)pyrrole-5-carboxylateRefChem:814535860-816-5MFCD082772222-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid methyl esterALBB-032422DUA23903AKOS000674336CCG-139097LS-12022
Show more names
CS-0080387D74163EN300-1703956F615365methyl2-methyl-4H-thieno[3,2-b]pyrrole-5-carboxylateF1907-1454Z1198177107
Database identifiers
- CAS
478239-03-1- PubChem CID
- 7516684
- EC Number
- 860-816-5
- Nikkaji
- J1.831.674I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 70.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 222
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H302-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H302-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
韶远科技（上海）有限公司4000665055 · [email protected]
上海旭晗化学科技有限公司15921303235 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [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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