Basic information
- CAS
53052-06-5- Standard SMILES
[S-]c1nc2ncccc2o1- InChIKey
BRSZJWYJYOGBGK-UHFFFAOYSA-M- Molecular formula
- C6H3N2OS-
- Average molar mass
- 151.17 g/mol
- Monoisotopic mass
- 150.9966089
Names & identifiers
- Preferred name
- [1,3]Oxazolo[4,5-b]pyridine-2-thiolate
- IUPAC
- [1,3]oxazolo[4,5-b]pyridine-2-thiolate
- English name
- OXAZOLO[4,5-B]PYRIDIN-2(3H)THIONE
- Molecular formula
- C6H4N2OS
- Molecular weight
- 152.17
Names & synonyms
DTXSID40967547[1,3]oxazolo[4,5-b]pyridine-2-thiolateBUTTPARK 19\09-84OXAZOLO[4,5-B]PYRIDINE-2-THIOL2-oxazolo[4,5-b]pyridinethiolateOXAZOLO[4,5-B]PYRIDIN-2(3H)THIONE[1,3]Oxazolo[4,5-b]pyridin-2-thiol3H-OXAZOLO[4,5-B]PYRIDINE-2-THIONE[1,3]OXAZOLO[4,5-B]PYRIDINE-2-THIOLOxazolo[4,5-b]pyridine-2(3H)-thione1,3-Oxazolo[4,5-b]pyridin-2(3H)thioneOxazolo[4,5-b]pyridin-2(3H)thione,99%
Database identifiers
- CAS
53052-06-5- PubChem CID
- 40468332
- DTXSID
DTXSID40967547
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 39.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- -1
- Complexity
- 133
Physicochemical properties
- Melting point
- 243 · 243-246 °C
- Density
- 1.402 · 1.402 (estimate)
- refractive index
- 1.643 · 1.6430 (estimate)
- storage temp.
- 2 · 2-8°C
- form
- solid
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 53052 · 53052-06-5
- 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
- Hazard Codes
- Xi
- Safety Statements
- 24 · 24/25
- HazardClass
- IRRITANT
- 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_code
- Xi
- safety_code
- 24/25
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H320-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers57 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [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]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Asset Chem-Tech Co., Ltd15965823333
上海瀚鸿科技股份有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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