BMMCBZ2Pd015
From Metabolomics.JP
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+ | {{Hierarchy|{{PAGENAME}}}} | ||
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{{Metabolite | {{Metabolite | ||
|SysName=4-Chloro-phenyl-acetonitrile | |SysName=4-Chloro-phenyl-acetonitrile | ||
− | |Common Name=&&4-Chlorophenylacetonitrile&&4-Chlorobenzyl cyanide&& | + | |Common Name=&&4-Chlorophenylacetonitrile&&4-Chlorobenzyl cyanide&&4-Chloro-phenyl-acetonitrile&& |
|CAS=140-53-4 | |CAS=140-53-4 | ||
|KEGG=C03679 | |KEGG=C03679 | ||
}} | }} |
Latest revision as of 23:36, 3 February 2009
Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMMC mono- or assembled cycle 単、複合環 : BMMCBZ benzene ring ベンゼン環 : BMMCBZ2P with 2 substitutions (para) (64 pages)
IDs and Links | |
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LipidBank | [1] |
LipidMaps | [2] |
CAS | 140-53-4 |
KEGG | C03679 |
KNApSAcK | |
CDX file | |
MOL file | BMMCBZ2Pd015.mol |
4-Chlorophenylacetonitrile | |
---|---|
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Structural Information | |
Systematic Name | 4-Chloro-phenyl-acetonitrile |
Common Name |
|
Symbol | |
Formula | C8H6ClN |
Exact Mass | 151.0188 |
Average Mass | 151.5926 |
SMILES | N#CCc(c1)ccc(Cl)c1 |
Physicochemical Information | |
Melting Point | |
Boiling Point | |
Density | |
Optical Rotation | |
Reflactive Index | |
Solubility | |
Spectral Information | |
Mass Spectra | |
UV Spectra | |
IR Spectra | |
NMR Spectra | |
Chromatograms |
Related Atomic Mappings, Enzymes, and Pathways