Basic information
- CAS
853109-70-3- Standard SMILES
CCOC(=O)c1cn(C)c(=O)c(C)c1Cl- InChIKey
LRPZMBUONONUPF-UHFFFAOYSA-N- Molecular formula
- C10H12ClNO3
- Average molar mass
- 229.66 g/mol
- Monoisotopic mass
- 229.05057092
Names & identifiers
- Preferred name
- Ethyl 4-chloro-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylate
- IUPAC
- ethyl 4-chloro-1,5-dimethyl-6-oxopyridine-3-carboxylate
- English name
- 4-Chloro-1,5-dimethyl-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid ethyl ester
- Molecular formula
- C10H12ClNO3
- Molecular weight
- 229.66
Names & synonyms
853109-70-3Ethyl 4-chloro-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylateMFCD090315234-CHLORO-1,5-DIMETHYL-6-OXO-1,6-DIHYDRO-PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTERethyl 4-chloro-1,5-dimethyl-6-oxopyridine-3-carboxylateSCHEMBL391397DTXSID20470504Ethyl 4-chloro-1,5-dimethyl-6-oxo-pyridine-3-carboxylateLRPZMBUONONUPF-UHFFFAOYSA-NEthyl4-chloro-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylateAKOS0159655094-chloro-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid ethyl ester
Show more names
AS-73561DA-33900SY125970CS-0061583Y10759F6098703-Pyridinecarboxylic acid, 4-chloro-1,6-dihydro-1,5-dimethyl-6-oxo-, ethyl ester
Database identifiers
- CAS
853109-70-3
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 371
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- Light yellow to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers14 total
陕西凯尔凯医药科技有限公司029-2148545164 17392779578 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
西安瑞成医药科技有限责任公司18291828687 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [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]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
石家庄宇拓科技有限公司15011393861; 15011393861 · [email protected]
艾览（上海）化工科技有限公司400-668-9898 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
Related reactions
15 records
Compound notes
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