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1739-84-0

1739-84-0 | 1,2-Dimethyl-1H-imidazole

CAS No: 1739-84-0 Catalog No: AG001Z9Y MDL No:MFCD00005294

Product Description

Catalog Number:
AG001Z9Y
Chemical Name:
1,2-Dimethyl-1H-imidazole
CAS Number:
1739-84-0
Molecular Formula:
C5H8N2
Molecular Weight:
96.1304
MDL Number:
MFCD00005294
IUPAC Name:
1,2-dimethylimidazole
InChI:
InChI=1S/C5H8N2/c1-5-6-3-4-7(5)2/h3-4H,1-2H3
InChI Key:
GIWQSPITLQVMSG-UHFFFAOYSA-N
SMILES:
Cn1ccnc1C
EC Number:
217-101-2
UNII:
Q41BC3GRJB
NSC Number:
111174

Properties

Complexity:
63.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
96.069g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
96.133g/mol
Monoisotopic Mass:
96.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

Literature

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Heme carbonyls: environmental effects on nu(C-O) and Fe-C/C-O bond length correlations. Journal of the American Chemical Society 20051019
Prevention of tumors of the large intestine by celecoxib in mice. In vivo (Athens, Greece) 20050101
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