Cas no 418794-93-1 (1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)-)
![1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)- structure](https://ossimg.kuujia.com/scimg/419000/418794-93-1x500.png)
418794-93-1 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)-
CAS No:418794-93-1
MF:C12H14N2O2
MW:218.251762866974
CID:835261
Update Time:2026-04-29
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)-
- 1-Isobutyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
-
- Inchi： InChI=1S/C12H14N2O2/c1-8(2)6-14-7-10(12(15)16)9-4-3-5-13-11(9)14/h3-5,7-8H,6H2,1-2H3,(H,15,16)
- InChI Key： JFHRQMXVOZGGNL-UHFFFAOYSA-N
- SMILES： CC(C)CN1C=C(C2=C1N=CC=C2)C(=O)O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 1-(2-methylpropyl)- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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