Basic information
- CAS
103440-65-9- Standard SMILES
Cc1nc2ccc(CO)cc2s1- InChIKey
KMABUKKLVPBEIB-UHFFFAOYSA-N- Molecular formula
- C9H9NOS
- Average molar mass
- 179.24 g/mol
- Monoisotopic mass
- 179.04048491
Names & identifiers
- Preferred name
- (2-Methylbenzo[D]thiazol-6-YL)methanol
- IUPAC
- (2-methyl-1,3-benzothiazol-6-yl)methanol
- English name
- 6-Benzothiazolemethanol,2-methyl-(6CI)
- Molecular formula
- C9H9NOS
- Molecular weight
- 179.24
Names & synonyms
103440-65-9(2-METHYLBENZO[D]THIAZOL-6-YL)METHANOL(2-methyl-1,3-benzothiazol-6-yl)methanol6-Benzothiazolemethanol,2-methyl-(6CI)MFCD029409012-Methyl-6-benzothiazolemethanol2-Methylbenzothiazole-6-methanol6-Benzothiazolemethanol, 2-methyl-Enamine_002463CHEMBL4568372SCHEMBL13035022SCHEMBL30174475
Show more names
KMABUKKLVPBEIB-UHFFFAOYSA-NDTXSID901301878HMS1400P21DEA44065AKOS001027185NCGC00321478-01AS-42690SY143262
Database identifiers
- CAS
103440-65-9- PubChem CID
- 676590
- DTXSID
DTXSID901301878- ChEMBL
CHEMBL4568372
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H320-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H320-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses(2-Methyl-1,3-benzothiazol-6-yl)methanol is used in the synthesis of thiazole derivatives. Also, it is derived from (B206863)
Suppliers11 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
广东翁江化学试剂有限公司0751-2815987 13927875076 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
上海锲诺医药科技有限公司021-021-51557188 15901710861 · [email protected]
Related reactions
2 records
Compound notes
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