Cas no 61129-15-5 (Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate)
![Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate structure](https://ossimg.kuujia.com/scimg/61500/61129-15-5x500.png)
61129-15-5 structure
Product Name:Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate
CAS No:61129-15-5
MF:C9H4Cl3N3O2
MW:292.505958557129
CID:953994
PubChem ID:320726
Update Time:2025-04-19
Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate
- 2,4,7-trichloro-pyrido[2,3-d]pyrimidine-5-carboxylic acid methyl ester
- AC1L82TP
- NSC269226
- NSC-269226
- 61129-15-5
- DTXSID90313353
- SCHEMBL9545085
-
- Inchi： 1S/C9H4Cl3N3O2/c1-17-8(16)3-2-4(10)13-7-5(3)6(11)14-9(12)15-7/h2H,1H3
- InChI Key： VZGUZGFRIUKCIQ-UHFFFAOYSA-N
- SMILES： ClC1C2C(N=C(N=1)Cl)=NC(=CC=2C(=O)OC)Cl
Computed Properties
- Exact Mass: 290.93712
- Monoisotopic Mass: 290.936909g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 307
- 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: 3.5
- Topological Polar Surface Area: 65?2
Experimental Properties
- PSA: 64.97
- LogP: 2.77160
Methyl 2,4,7-trichloropyrido[2,3-d]pyrimidine-5-carboxylate Related Literature
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1. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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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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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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