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20075-29-0 | 1H-Imidazole, 1-(1-methylpropyl)-
CAS No: 20075-29-0 Catalog No: AG002CY3 MDL No:MFCD06421461
Product Description
Catalog Number:
AG002CY3
Chemical Name:
1H-Imidazole, 1-(1-methylpropyl)-
CAS Number:
20075-29-0
Molecular Formula:
C7H12N2
Molecular Weight:
124.1836
MDL Number:
MFCD06421461
IUPAC Name:
1-butan-2-ylimidazole
InChI:
InChI=1S/C7H12N2/c1-3-7(2)9-5-4-8-6-9/h4-7H,3H2,1-2H3
InChI Key:
GYKNBGLKLKMMJO-UHFFFAOYSA-N
SMILES:
CCC(n1cncc1)C
Properties
Complexity:
83
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.187g/mol
Monoisotopic Mass:
124.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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