Cas no 7038-65-5 (N,n-dibutyl-4,6-dichloropyrimidin-2-amine)
7038-65-5 structure
Product Name:N,n-dibutyl-4,6-dichloropyrimidin-2-amine
CAS No:7038-65-5
MF:C12H19Cl2N3
MW:276.205360651016
CID:975068
PubChem ID:231257
Update Time:2025-04-19
N,n-dibutyl-4,6-dichloropyrimidin-2-amine Chemical and Physical Properties
Names and Identifiers
-
- N,n-dibutyl-4,6-dichloropyrimidin-2-amine
- 2-Di-n-butylamino-4,6-dichlorpyrimidin
- AC1L5LAS
- AC1Q3PRU
- AR-1K1812
- dibutyl-(4,6-dichloro-pyrimidin-2-yl)-amine
- NSC27081
- 7038-65-5
- NSC-27081
- DTXSID80990571
-
- Inchi： 1S/C12H19Cl2N3/c1-3-5-7-17(8-6-4-2)12-15-10(13)9-11(14)16-12/h9H,3-8H2,1-2H3
- InChI Key： LRAFCRBFKIOMBN-UHFFFAOYSA-N
- SMILES： ClC1=CC(=NC(=N1)N(CCCC)CCCC)Cl
Computed Properties
- Exact Mass: 275.09587
- Monoisotopic Mass: 275.0956030g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 7
- Complexity: 186
- 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: 5.1
- Topological Polar Surface Area: 29?2
Experimental Properties
- PSA: 29.02
- LogP: 4.19000
N,n-dibutyl-4,6-dichloropyrimidin-2-amine Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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