Cas no 83217-40-7 (Benzenamine, 4-(4,6-dichloro-2-pyrimidinyl)-)
83217-40-7 structure
Product Name:Benzenamine, 4-(4,6-dichloro-2-pyrimidinyl)-
CAS No:83217-40-7
MF:C10H7Cl2N3
MW:240.088679552078
CID:675660
PubChem ID:20165522
Update Time:2025-04-19
Benzenamine, 4-(4,6-dichloro-2-pyrimidinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 4-(4,6-dichloro-2-pyrimidinyl)-
- 4-(4,6-dichloropyrimidin-2-yl)aniline
- SCHEMBL10498625
- SB60205
- 83217-40-7
- DTXSID00603232
-
- Inchi： 1S/C10H7Cl2N3/c11-8-5-9(12)15-10(14-8)6-1-3-7(13)4-2-6/h1-5H,13H2
- InChI Key： ZRPGJAFGRMSTPH-UHFFFAOYSA-N
- SMILES： ClC1=CC(=NC(C2C=CC(=CC=2)N)=N1)Cl
Computed Properties
- Exact Mass: 239.0017026g/mol
- Monoisotopic Mass: 239.0017026g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 197
- 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: 51.8?2
Benzenamine, 4-(4,6-dichloro-2-pyrimidinyl)- Related Literature
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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