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4532-96-1 | 1-Isopropyl-1H-imidazole
CAS No: 4532-96-1 Catalog No: AG0032SJ MDL No:MFCD00234239
Product Description
Catalog Number:
AG0032SJ
Chemical Name:
1-Isopropyl-1H-imidazole
CAS Number:
4532-96-1
Molecular Formula:
C6H10N2
Molecular Weight:
110.1570
MDL Number:
MFCD00234239
IUPAC Name:
1-propan-2-ylimidazole
InChI:
InChI=1S/C6H10N2/c1-6(2)8-4-3-7-5-8/h3-6H,1-2H3
InChI Key:
IPIORGCOGQZEHO-UHFFFAOYSA-N
SMILES:
CC(n1cncc1)C
Properties
Complexity:
70.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.16g/mol
Monoisotopic Mass:
110.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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