Cas no 14077-70-4 (Pyrimidine,2,4,6-trichloro-5-hexyl-)
14077-70-4 structure
Product Name:Pyrimidine,2,4,6-trichloro-5-hexyl-
CAS No:14077-70-4
MF:C10H13Cl3N2
MW:267.582619428635
CID:219493
PubChem ID:260787
Update Time:2025-04-19
Pyrimidine,2,4,6-trichloro-5-hexyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,2,4,6-trichloro-5-hexyl-
- 2,4,6-trichloro-5-heptyl-pyrimidine
- 2,4,6-trichloro-5-hexyl-pyrimidine
- AC1L63VS
- AC1Q3PQJ
- AR-1L2800
- CTK4C2343
- NSC92506
- Pyrimidine, 2,4,6-trichloro-5-heptyl-
- DTXSID40930918
- 2,4,6-trichloro-5-hexylpyrimidine
- NSC-92502
- 14077-70-4
- NSC92502
-
- Inchi： 1S/C10H13Cl3N2/c1-2-3-4-5-6-7-8(11)14-10(13)15-9(7)12/h2-6H2,1H3
- InChI Key： MBDPAJFXCANJIP-UHFFFAOYSA-N
- SMILES： ClC1C(=C(N=C(N=1)Cl)Cl)CCCCCC
Computed Properties
- Exact Mass: 266.01469
- Monoisotopic Mass: 266.014432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 168
- 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: 6.1
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
- LogP: 4.55960
Pyrimidine,2,4,6-trichloro-5-hexyl- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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