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Home > Imidazoles > 1311316-85-4
1311316-85-4 | 2-methyl-1-(prop-2-yn-1-yl)-1H-imidazole hydrochloride
CAS No: 1311316-85-4 Catalog No: AG01AHNW MDL No:MFCD18785543
Product Description
Catalog Number:
AG01AHNW
Chemical Name:
2-methyl-1-(prop-2-yn-1-yl)-1H-imidazole hydrochloride
CAS Number:
1311316-85-4
Molecular Formula:
C7H9ClN2
Molecular Weight:
156.6128
MDL Number:
MFCD18785543
IUPAC Name:
2-methyl-1-prop-2-ynylimidazole;hydrochloride
InChI:
InChI=1S/C7H8N2.ClH/c1-3-5-9-6-4-8-7(9)2;/h1,4,6H,5H2,2H3;1H
InChI Key:
XIGCELHEKQRFRI-UHFFFAOYSA-N
SMILES:
Cc1nccn1CC#C.Cl
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.045g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.613g/mol
Monoisotopic Mass:
156.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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