Basic information
- CAS
17438-14-1- Standard SMILES
COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1- InChIKey
FKDYIXOYTANTSV-UHFFFAOYSA-N- Molecular formula
- C11H15NO4
- Average molar mass
- 225.24 g/mol
- Monoisotopic mass
- 225.10010796
Names & identifiers
- Preferred name
- Dimethyl 1,4-dihydro-2,6-dimethylpyridine-3,5-dicarboxylate
- IUPAC
- dimethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
- English name
- dimethyl 1,4-dihydro-2,6-dimethylpyridine-3,5-dicarboxylate
- Molecular formula
- C11H15NO4
- Molecular weight
- 225.24
Names & synonyms
17438-14-1Dimethyl 1,4-dihydro-2,6-dimethylpyridine-3,5-dicarboxylate3,5-Dimethyl 1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylateEINECS 241-458-3DTXSID20169820RefChem:588104DTXCID1092311241-458-3Dimethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylateMaybridge4_001804Nifedipine Impurity 50Oprea1_491268
Show more names
3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-, dimethyl est er2,6-Dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylicaciddimethylester2,6-Dimethyl-1,4-dihydro-3,5-pyridinedicarboxylic acid dimethyl ester1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic acid dimethyl ester3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-, 3,5-dimethyl ester
SCHEMBL3295915HMS1526B22AKOS000313772CCG-2513872,6-DIMETHYL-1,4-DIHYDRO-PYRIDINE-3,5-DICARBOXYLIC ACID DIMETHYL ESTERNCGC00177241-01DB-394216NS00025734
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 357
Physicochemical properties
- Melting point
- 231 · 231-233 °C
- Boiling point
- 321.9 · 321.9±42.0 °C(Predicted)
- Density
- 1.147 · 1.147±0.06 g/cm3(Predicted)
- pka
- 3.35 · 3.35±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
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 39 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
Applications
UsesDimethyl 2,6-Dimethyl-1,4-dihydropyridine-3,5-dicarboxylate is used in method for synthesizing 3,4-dihydropyrimidinone compound by asymmetric transfer hydrogenation.
Suppliers12 total
济南百隆化学有限公司[email protected] · [email protected]
山东艾莎科技有限公司15092135101 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
上海颐碳化学科技有限公司13774412103 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
石家庄飞孜化工科技有限公司0311-85957988 18633001459 · [email protected]
深圳晴天生物技术有限公司18823167005 18162969855 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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