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1269151-12-3 | 2-phenyl-1-(prop-2-yn-1-yl)-1H-imidazole hydrochloride
CAS No: 1269151-12-3 Catalog No: AG01AGUV MDL No:MFCD18380678
Product Description
Catalog Number:
AG01AGUV
Chemical Name:
2-phenyl-1-(prop-2-yn-1-yl)-1H-imidazole hydrochloride
CAS Number:
1269151-12-3
Molecular Formula:
C12H11ClN2
Molecular Weight:
218.6821
MDL Number:
MFCD18380678
IUPAC Name:
2-phenyl-1-prop-2-ynylimidazole;hydrochloride
InChI:
InChI=1S/C12H10N2.ClH/c1-2-9-14-10-8-13-12(14)11-6-4-3-5-7-11;/h1,3-8,10H,9H2;1H
InChI Key:
QQZITHGCSGWQFC-UHFFFAOYSA-N
SMILES:
C#CCn1ccnc1c1ccccc1.Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.061g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.684g/mol
Monoisotopic Mass:
218.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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