Basic information
- CAS
18529-69-6- Standard SMILES
Cc1ncc(C(=O)O)c(=O)[nH]1- InChIKey
CYCCXSJJYXCULN-UHFFFAOYSA-N- Molecular formula
- C6H6N2O3
- Average molar mass
- 154.12 g/mol
- Monoisotopic mass
- 154.03784206
Names & identifiers
- Preferred name
- 2-Methyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acid
- IUPAC
- 2-methyl-6-oxo-1H-pyrimidine-5-carboxylic acid
- English name
- 4-Hydroxy-2-methylpyrimidine-5-carboxylic acid
- Molecular formula
- C6H6N2O3
- Molecular weight
- 154.12
Names & synonyms
2-methyl-6-oxo-1,6-dihydropyrimidine-5-carboxylic acidDTXSID00304318RefChem:475817DTXCID80255450870-650-518529-69-64-hydroxy-2-methylpyrimidine-5-carboxylic acid2-methyl-6-oxo-1H-pyrimidine-5-carboxylic acid4-Hydroxy-2-methyl-pyrimidine-5-carboxylic acid2-methyl-6-oxo-1,6-dihydro-5-pyrimidinecarboxylic acidMFCD08704418MFCD10686628
Show more names
5-Pyrimidinecarboxylic acid, 1,6-dihydro-2-methyl-6-oxo-2-methyl-6-oxo-1,6-dihydro-5-pyrimidinecarboxylic acid(SALTDATA: FREE)
4-Hydroxy-2-methyl-5-pyrimidinecarboxylic acidNSC165386SCHEMBL5884203SCHEMBL239004145-Pyrimidinecarboxylic acid, 1,4-dihydro-2-methyl-4-oxo- (9CI)STL138369AKOS000112084AKOS000302408
Database identifiers
- CAS
18529-69-6- PubChem CID
- 295779
- DTXSID
DTXSID00304318- EC Number
- 870-650-5
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 278
Physicochemical properties
- Density
- 1.52 · 1.52±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- -0.01 · -0.01±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
- HazardClass
- IRRITANT
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Chemistry & industry
Suppliers18 total
Shaanxi Cuikang Pharmaceutical Technology Co., Ltd+86-13119157289 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
济南铭雅医药科技有限公司0531-85828981 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
南通开盛生物科技有限公司13951303301;13951303301 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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