Basic information
- CAS
27433-55-2- Standard SMILES
Cc1nc2c(=O)[nH]cnc2o1- InChIKey
VHNKDSNYFRHJMK-UHFFFAOYSA-N- Molecular formula
- C6H5N3O2
- Average molar mass
- 151.12 g/mol
- Monoisotopic mass
- 151.03817641
Names & identifiers
- Preferred name
- 2-Methyl(1,3)oxazolo(5,4-d)pyrimidin-7-ol
- IUPAC
- 2-methyl-6H-[1,3]oxazolo[5,4-d]pyrimidin-7-one
- English name
- AKOS 91437
- Molecular formula
- C6H5N3O2
- Molecular weight
- 151.12
Names & synonyms
27433-55-22-Methyloxazolo[5,4-d]pyrimidin-7(6H)-one2-Methyl(1,3)oxazolo(5,4-d)pyrimidin-7-olU6M6ZW93VUNSC 133683UNII-U6M6ZW93VUNSC-1336832-Methyl[1,3]oxazolo[5,4-d]pyrimidin-7-ol2-METHYLOXAZOLO(5,4-D)PYRIMIDIN-7-OLDTXSID101818542-methyloxazolo[5,4-d]pyrimidin-7-olOXAZOLO(5,4-D)PYRIMIDIN-7-OL, 2-METHYL-
Show more names
AKOS 91437Oxazolo[5,4-d]pyrimidin-7(6H)-one,2-methyl-2-methyl[1,3]oxazolo[5,4-d]pyrimidin-7(6H)-one(SALTDATA: FREE)
2-METHYLOXAZOLO(5,4-D)PYRIMIDIN-7(6H)-ONEOXAZOLO(5,4-D)PYRIMIDIN-7(4H)-ONE, 2-METHYL-OXAZOLO(5,4-D)PYRIMIDIN-7(6H)-ONE, 2-METHYL-RefChem:87953DTXCID501043452-methyl[1,3]oxazolo[5,4-d]pyrimidin-7(6h)-one2-methyl-6H-[1,3]oxazolo[5,4-d]pyrimidin-7-oneMFCD08694545
Database identifiers
- CAS
27433-55-2- PubChem CID
- 281136
- DTXSID
DTXSID10181854- UNII
- U6M6ZW93VU
- EC Number
- 872-358-3
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- form
- solid
- InChI
- 1S/C6H5N3O2/c1-3-9-4-5(10)7-2-8-6(4)11-3/h2H,1H3,(H,7,8,10)
- InChIKey
- VHNKDSNYFRHJMK-UHFFFAOYSA-N
- SMILES
- O=C1C2=C(N=CN1)OC(C)=N2
- FDA UNII
- 6 M6ZW93VU · U6M6ZW93VU
- UNSPSC Code
- 12352200 · 12352200
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 Oral · Acute Tox. 4 Oral
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]
P264, P270, P301+P317, P330, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers8 total
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海玉函化工有限公司021-61469567 13774476675 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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