Basic information
- CAS
86129-62-6- Standard SMILES
CCOC(=O)c1c(Cl)cc(C)[nH]c1=O- InChIKey
LCAOURNJLXCNNF-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO3
- Average molar mass
- 215.63 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-chloro-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
- IUPAC
- ethyl 4-chloro-6-methyl-2-oxo-1H-pyridine-3-carboxylate
- English name
- ethyl 1,2-dihydro-2-oxo-4-chloro-6-methylpyridine-3-carboxylate
- Molecular formula
- C9H10ClNO3
- Molecular weight
- 215.63
Names & synonyms
ethyl 4-chloro-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate86129-62-6RefChem:595388816-816-2ethyl 4-chloro-6-methyl-2-oxo-1H-pyridine-3-carboxylateMFCD24555889SCHEMBL1062191LCAOURNJLXCNNF-UHFFFAOYSA-NLDA12962BS-46780SY208895DB-157735
Show more names
ethyl 1,2-dihydro-2-oxo-4-chloro-6-methylpyridine-3-carboxylate3-Pyridinecarboxylic acid, 4-chloro-1,2-dihydro-6-methyl-2-oxo-, ethyl ester
E84624EN300-252084ethyl4-chloro-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
Database identifiers
- CAS
86129-62-6- PubChem CID
- 57859986
- EC Number
- 816-816-2
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Boiling point
- 346.7 · 346.7±42.0 °C(Predicted)
- Density
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- pka
- 8.79 · 8.79±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
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 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers11 total
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
常州宣叶科技有限公司15195022192 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
Cochemical Co. Ltd.+86-029-86115547 +86-17791676824 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
Related reactions
4 records
Compound notes
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