Cas no 934568-21-5 (1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester)
![1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester structure](https://ossimg.kuujia.com/scimg/935000/934568-21-5x500.png)
934568-21-5 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester
CAS No:934568-21-5
MF:C10H10N2O2
MW:190.198602199554
CID:835294
PubChem ID:57856368
Update Time:2025-04-19
1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester
- 1-METHYL-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBOXYLIC ACID METHYL ESTER
- Methyl 1-methyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
- RFLWILHVWKWWLN-UHFFFAOYSA-N
- methyl 1-methylpyrrolo[2,3-b]pyridine-5-carboxylate
- SCHEMBL13199654
- 934568-21-5
-
- Inchi： 1S/C10H10N2O2/c1-12-4-3-7-5-8(10(13)14-2)6-11-9(7)12/h3-6H,1-2H3
- InChI Key： RFLWILHVWKWWLN-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CN=C2C(=C1)C=CN2C)=O
Computed Properties
- Exact Mass: 190.074227566g/mol
- Monoisotopic Mass: 190.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 232
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 44.1?2
1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-, methyl ester Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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