Basic information
- CAS
118892-73-2- Standard SMILES
CC(C)OC(=O)c1ncccc1C(=O)[O-]- InChIKey
ISSPPDIMZKGLKN-UHFFFAOYSA-M- Molecular formula
- C10H10NO4-
- Average molar mass
- 208.19 g/mol
- Monoisotopic mass
- 208.0609828
Names & identifiers
- Preferred name
- 2,3-Pyridinedicarboxylic acid, 2-(1-methylethyl) ester
- IUPAC
- 2-propan-2-yloxycarbonylpyridine-3-carboxylate
- English name
- 2,3-Pyridinedicarboxylic acid, 2-(1-Methylethyl) ester
- Molecular formula
- C10H11NO4
- Molecular weight
- 209.2
Names & synonyms
118892-73-22,3-Pyridinedicarboxylic acid, 2-(1-methylethyl) ester2-propan-2-yloxycarbonylpyridine-3-carboxylateMFCD01075650C10H10NO4-DTXSID306516802-isopropoxycarbonylpyridine-3-carboxylate2-{[(Propan-2-yl)oxy]carbonyl}pyridine-3-carboxylate2-(isopropoxycarbonyl)nicotinic acid2-(ISOPROPOXYCARBONYL)NICOTINIC ACID(WXG02574)Pyridine-2,3-dicarboxylic acid 2-isopropyl ester2,3-pyridinedicarboxylic acid 2-(isopropyl ester)
Show more names
2-Propan-2-yloxycarbonylpyridine-3-carboxylic acid
Database identifiers
- CAS
118892-73-2- PubChem CID
- 28811908
- DTXSID
DTXSID30651680
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- -1
- Complexity
- 246
Physicochemical properties
- Boiling point
- 384.4 · 384.4±27.0 °C(Predicted)
- Density
- 1.256 · 1.256±0.06 g/cm3(Predicted)
- pka
- 2.76 · 2.76±0.36(Predicted)
Chemistry & industry
Suppliers11 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [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]
南京麦瑞米生物技术有限公司025-87782433 18021532344 · [email protected]
深圳利斯康医药科技有限公司+86-755-89396905 +86-15013857715 · [email protected]
郑州艾克姆化工有限公司13303867194 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
联化昂健医药科技（上海）有限公司18918657159 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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