Basic information
- CAS
35212-87-4- Standard SMILES
COC(=O)c1sc2cc(Cl)ccc2c1N- InChIKey
QWXWNCOUMITXRA-UHFFFAOYSA-N- Molecular formula
- C10H8ClNO2S
- Average molar mass
- 241.69 g/mol
- Monoisotopic mass
- 240.99642718
Names & identifiers
- Preferred name
- Benzo[b]thiophene-2-carboxylic acid, 3-amino-6-chloro-, methyl ester
- IUPAC
- methyl 3-amino-6-chloro-1-benzothiophene-2-carboxylate
- English name
- 3-Amino-6-chloro-benzo[b]thiophene-2-carboxylic acid methyl ester
- Molecular formula
- C10H8ClNO2S
- Molecular weight
- 241.69
Names & synonyms
35212-87-4Benzo[b]thiophene-2-carboxylic acid, 3-amino-6-chloro-, methyl esterBenzo(b)thiophene-2-carboxylic acid, 3-amino-6-chloro-, methyl esterRefChem:326203methyl 3-amino-6-chlorobenzo[b]thiophene-2-carboxylateMFCD12032271methyl 3-amino-6-chloro-1-benzothiophene-2-carboxylate3-Amino-6-chloro-benzo[b]thiophene-2-carboxylic acid methyl esterSCHEMBL8142110SCHEMBL31015931WLZ3441QWXWNCOUMITXRA-UHFFFAOYSA-N
Show more names
Methyl 3-amino-6-chlorobenzothiophene-2-carboxylate3-Amino-6-chloro-benzo[b]thiophene-2-carboxylic acid methyl
DTXSID401159979AS-93639SY358969DB-1092893-Amino-2-carbomethoxy-6-chloro-benzthiopheneF71910F550730methyl 3-amino-6-chloro-benzothiophene-2-carboxylate
Database identifiers
- CAS
35212-87-4- PubChem CID
- 14916787
- DTXSID
DTXSID401159979
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers27 total
郑州海阔光电材料有限公司67759225 13526468238 · [email protected]
咸宁深蓝生物医药研发有限公司18171815831 · [email protected]
郑州海阔光电材料有限公司+86-371-55919009 +8615225108189 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
南京环合生物科技有限公司18605270162 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
苏州启航生物科技有限公司18151111370
武汉泰凯塞科技有限公司027-86697669 13986148687 · [email protected]
郑州九亿时光新材料有限公司+86-15225627621 +86-13213167925 · [email protected]
淄博诚桥医化技术有限公司0533-2196219; 13864320634 · [email protected]
济南碳泉新材料有限公司13658618215
许昌峰飞新材料科技有限公司19713077352; 19713077352 · [email protected]
苏州施亚生物科技有限公司0512-0512-52358471 17715136450 · [email protected]
武汉沃格达生物科技有限公司15071299552 · [email protected]
上海祉夏化工科技有限公司15216847143 18321145570 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
苏州宝圣医药科技有限公司18616776591 · [email protected]
西安瑞芬达生物技术有限公司19929974101 //1144079830; 19929974101 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
湖北省善乐兴生物科技有限公司18321145570 · [email protected]
Zhengzhou Lingzhiyue Technology Co., Ltd+86-0371-55074660 +86-13523716970 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
1 records
Compound notes
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