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288-30-2 | 4H-Imidazole
CAS No: 288-30-2 Catalog No: AG002WJC MDL No:
Product Description
Catalog Number:
AG002WJC
Chemical Name:
4H-Imidazole
CAS Number:
288-30-2
Molecular Formula:
C3H4N2
Molecular Weight:
68.0773
IUPAC Name:
4H-imidazole
InChI:
InChI=1S/C3H4N2/c1-2-5-3-4-1/h1,3H,2H2
InChI Key:
LGRQUXHYJBFGTM-UHFFFAOYSA-N
SMILES:
C1=NCC=N1
Properties
Complexity:
73
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
68.037g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
68.079g/mol
Monoisotopic Mass:
68.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Conversion of alpha,beta-unsaturated aldehydes into saturated esters: an Umpolung reaction catalyzed by nucleophilic carbenes. | Organic letters 20050303 |
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