Cas no 2363785-48-0 (methyl-d3 5-bromopyrimidine-2-carboxylate)
2363785-48-0 structure
Product Name:methyl-d3 5-bromopyrimidine-2-carboxylate
CAS No:2363785-48-0
MF:C6H5BrN2O2
MW:220.038585424423
CID:6824790
PubChem ID:172402145
Update Time:2025-03-01
methyl-d3 5-bromopyrimidine-2-carboxylate Chemical and Physical Properties
Names and Identifiers
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- 2363785-48-0
- CS-22875
- methyl-d3 5-bromopyrimidine-2-carboxylate
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- Inchi： 1S/C6H5BrN2O2/c1-11-6(10)5-8-2-4(7)3-9-5/h2-3H,1H3/i1D3
- InChI Key： XILAKTMDKMVJQV-FIBGUPNXSA-N
- SMILES： BrC1C=NC(C(=O)OC([2H])([2H])[2H])=NC=1
Computed Properties
- Exact Mass: 218.97227Da
- Monoisotopic Mass: 218.97227Da
- Isotope Atom Count: 3
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 146
- 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: 0
- Topological Polar Surface Area: 52.1?2
methyl-d3 5-bromopyrimidine-2-carboxylate Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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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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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
2363785-48-0 (methyl-d3 5-bromopyrimidine-2-carboxylate) Related Products
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