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Home > Imidazoles > 65109-28-6
65109-28-6 | 2-isopropyl-1H-imidazole-1-propiononitrile
CAS No: 65109-28-6 Catalog No: AG00EZC5 MDL No:
Product Description
Catalog Number:
AG00EZC5
Chemical Name:
2-isopropyl-1H-imidazole-1-propiononitrile
CAS Number:
65109-28-6
IUPAC Name:
3-(2-propan-2-ylimidazol-1-yl)propanenitrile
InChI:
InChI=1S/C9H13N3/c1-8(2)9-11-5-7-12(9)6-3-4-10/h5,7-8H,3,6H2,1-2H3
InChI Key:
SIALAAQDYFPPFQ-UHFFFAOYSA-N
EC Number:
265-448-3
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.224g/mol
Monoisotopic Mass:
163.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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