Cas no 1184918-12-4 (4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid)
![4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid structure](https://ossimg.kuujia.com/scimg/1185000/1184918-12-4x500.png)
1184918-12-4 structure
Product Name:4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid
CAS No:1184918-12-4
MF:C10H10ClN3O2
MW:239.658300876617
CID:2615813
PubChem ID:42609109
Update Time:2025-04-21
4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid
- 4-chloro-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid
- DTXSID10654912
- 4-Chloro-7-(propan-2-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid
- AKOS015916956
- 7h-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid,4-chloro-7-(1-methylethyl)-
- 1184918-12-4
-
- Inchi： 1S/C10H10ClN3O2/c1-5(2)14-3-6(10(15)16)7-8(11)12-4-13-9(7)14/h3-5H,1-2H3,(H,15,16)
- InChI Key： CNIXTIJPWLXRTI-UHFFFAOYSA-N
- SMILES： ClC1=C2C(C(=O)O)=CN(C2=NC=N1)C(C)C
Computed Properties
- Exact Mass: 239.0461543Da
- Monoisotopic Mass: 239.0461543Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 287
- 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: 1.8
- Topological Polar Surface Area: 68?2
4-chloro-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carboxylic acid Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Ruili Liu,Mengping Gao,Jing Zhang,Zhilian Li,Jinyang Chen,Ping Liu,Dongqing Wu RSC Adv., 2015,5, 24205-24209
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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