Cas no 15951-30-1 (2-chloro-6-methyl-3,5-dinitro-pyridine)
15951-30-1 structure
Product Name:2-chloro-6-methyl-3,5-dinitro-pyridine
CAS No:15951-30-1
MF:C6H4ClN3O4
MW:217.566659927368
CID:1338557
PubChem ID:53424474
Update Time:2025-04-20
2-chloro-6-methyl-3,5-dinitro-pyridine Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-6-methyl-3,5-dinitro-pyridine
- 2-chloro-6-methyl-3,5-dinitropyridine
- pyridine, 2-chloro-6-methyl-3,5-dinitro-
- LogP
- DTXSID70698514
- 15951-30-1
- AKOS015966214
-
- Inchi： 1S/C6H4ClN3O4/c1-3-4(9(11)12)2-5(10(13)14)6(7)8-3/h2H,1H3
- InChI Key： SMTSVFRZTHCNRS-UHFFFAOYSA-N
- SMILES： ClC1=C(C=C(C(C)=N1)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 216.98912
- Monoisotopic Mass: 216.989
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 250
- 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
- Topological Polar Surface Area: 105A^2
- XLogP3: 1.9
Experimental Properties
- Density: 1.616
- Boiling Point: 331.4°C at 760 mmHg
- Flash Point: 154.2°C
- Refractive Index: 1.618
- PSA: 99.17
2-chloro-6-methyl-3,5-dinitro-pyridine Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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