Cas no 126504-87-8 (2,5-Bis(chloromethyl)pyrimidine)
126504-87-8 structure
Product Name:2,5-Bis(chloromethyl)pyrimidine
2,5-Bis(chloromethyl)pyrimidine Chemical and Physical Properties
Names and Identifiers
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- AB58929
- AKOS006304117
- 126504-87-8
- 2,5-BIS(CHLOROMETHYL)PYRIMIDINE
- 2,5-Bis(chloromethyl)pyrimidine
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- Inchi： 1S/C6H6Cl2N2/c7-1-5-3-9-6(2-8)10-4-5/h3-4H,1-2H2
- InChI Key： HZLBEEAMWXSDIA-UHFFFAOYSA-N
- SMILES： C1(CCl)=NC=C(CCl)C=N1
Computed Properties
- Exact Mass: 175.9908036Da
- Monoisotopic Mass: 175.9908036Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 91.7
- 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
- Topological Polar Surface Area: 25.8?2
2,5-Bis(chloromethyl)pyrimidine Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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