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20815-27-4 | Pyridine, 2-heptyl-
CAS No: 20815-27-4 Catalog No: AG002JJ4 MDL No:MFCD20527994
Product Description
Catalog Number:
AG002JJ4
Chemical Name:
Pyridine, 2-heptyl-
CAS Number:
20815-27-4
Molecular Formula:
C12H19N
Molecular Weight:
177.2860
MDL Number:
MFCD20527994
IUPAC Name:
2-heptylpyridine
InChI:
InChI=1S/C12H19N/c1-2-3-4-5-6-9-12-10-7-8-11-13-12/h7-8,10-11H,2-6,9H2,1H3
InChI Key:
DYCPESWJKDONHC-UHFFFAOYSA-N
SMILES:
CCCCCCCc1ccccn1
EC Number:
244-056-6
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.152g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.291g/mol
Monoisotopic Mass:
177.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| Formation of a hydrogen-bonded heptazine framework by self-assembly of melem into a hexagonal channel structure. | Chemistry (Weinheim an der Bergstrasse, Germany) 20120312 |
| Nonlinear optical properties of carbon nitride nanotubes. | Physical chemistry chemical physics : PCCP 20120114 |
| Computational design and structure-property relationship studies on heptazines. | Journal of molecular modeling 20111101 |
| Poly(triazine imide) with intercalation of lithium and chloride ions [(C3N3)2(NH(x)Li(1-x))3⋅LiCl]: a crystalline 2D carbon nitride network. | Chemistry (Weinheim an der Bergstrasse, Germany) 20110307 |
| Metal-functionalized single-walled graphitic carbon nitride nanotubes: a first-principles study on magnetic property. | Nanoscale research letters 20110101 |
| Nitrogen-rich carbon nitride hollow vessels: synthesis, characterization, and their properties. | The journal of physical chemistry. B 20100729 |
| From triazines to heptazines: deciphering the local structure of amorphous nitrogen-rich carbon nitride materials. | Journal of the American Chemical Society 20080611 |
| Ionothermal synthesis of crystalline, condensed, graphitic carbon nitride. | Chemistry (Weinheim an der Bergstrasse, Germany) 20080101 |
| Ab initio calculation of solid-state NMR spectra for different triazine and heptazine based structure proposals of g-C3N4. | The journal of physical chemistry. B 20070913 |
| Nitrogen-rich carbon nitride network materials via the thermal decomposition of 2,5,8-triazido-s-heptazine. | Inorganic chemistry 20070402 |
| The tautomeric forms of cyameluric acid derivatives. | Chemistry (Weinheim an der Bergstrasse, Germany) 20070101 |
| Unmasking melon by a complementary approach employing electron diffraction, solid-state NMR spectroscopy, and theoretical calculations-structural characterization of a carbon nitride polymer. | Chemistry (Weinheim an der Bergstrasse, Germany) 20070101 |
| Synthesis, characterization, and energetic properties of diazido heteroaromatic high-nitrogen C-N compound. | Journal of the American Chemical Society 20050914 |
| Alkalicyamelurates, M3[C6N7O3].xH2O, M = Li, Na, K, Rb, Cs: UV-luminescent and thermally very stable ionic tri-s-triazine derivatives. | Dalton transactions (Cambridge, England : 2003) 20041121 |
| Synthesis and structure of 2,5,8-triazido-s-heptazine: an energetic and luminescent precursor to nitrogen-rich carbon nitrides. | Journal of the American Chemical Society 20040505 |
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