Basic information
- CAS
51984-71-5- Standard SMILES
CCOC(=O)c1cc([N+](=O)[O-])cnc1C- InChIKey
PBYXNPIXRRSBFZ-UHFFFAOYSA-N- Molecular formula
- C9H10N2O4
- Average molar mass
- 210.19 g/mol
- Monoisotopic mass
- 210.0640568
Names & identifiers
- Preferred name
- Ethyl 2-methyl-5-nitronicotinate
- IUPAC
- ethyl 2-methyl-5-nitropyridine-3-carboxylate
- English name
- Ethyl 2-methyl-5-nitronicotinate
- Molecular formula
- C9H10N2O4
- Molecular weight
- 210.19
Names & synonyms
51984-71-5Ethyl 2-methyl-5-nitronicotinateEthyl 2-methyl-5-nitro-3-pyridinecarboxylateethyl 2-methyl-5-nitropyridine-3-carboxylate2-Methyl-5-nitro-nicotinic acid ethyl esterMFCD00753850ethyl 2-methyl-5-nitro-pyridine-3-carboxylate3-Pyridinecarboxylic acid, 2-methyl-5-nitro-, ethyl esterNSC146799Oprea1_284785Oprea1_597871SCHEMBL2332293
Show more names
ETHYL 2-METHYL-5-NITRONICOTITEPyridinecarboxylicacid,2-Methyl-5-nitro-,ethylester3-Pyridinecarboxylicacid, 2-Methyl-5-nitro-, ethyl ester
DTXSID00301867Ethyl 2-methyl-5-nitronicotinate #AKOS000118449CS-W000714DS-0281NSC-146799PB17182AC-25185
Database identifiers
- CAS
51984-71-5- PubChem CID
- 287239
- DTXSID
DTXSID00301867
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Melting point
- 64 · 64-65 °C
- Boiling point
- 309.6 · 309.6±37.0 °C(Predicted)
- Density
- 1.272 · 1.272±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- -0.02 · -0.02±0.20(Predicted)
- Appearance
- White to yellow Solid
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers96 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
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Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
Aladdin Scientific[email protected]
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Shangchem Co., Ltd.+86-21-68182121
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南京哈柏医药科技有限公司13376080562 13376090521 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
ChemeGen 中国18818260767 · [email protected]
skychemical Co.Ltd021-20958197 20965099 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
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合肥恩立医药科技有限公司0551-66399836 18955197623 · [email protected]
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上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
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上海孚一生物科技有限公司+86 (21) 61124340
池州凯隆进出口贸易有限公司[email protected]
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上海皓之翔生物科技有限公司（原上海拓青化工有限公司）526763801 13301653310 · [email protected]
诺尔凯立科技有限公司86-(0)21-31261262 373522135 · [email protected]
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嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
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Related reactions
7 records
Compound notes
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