Home Other Building Blocks 2-(prop-2-en-1-yl)-1H-1,3-benzodiazole hydrochloride

2-(prop-2-en-1-yl)-1H-1,3-benzodiazole hydrochloride

CAS No.:
1423034-64-3
Catalog Number:
AG01A1KM
Molecular Formula:
C10H11ClN2
Molecular Weight:
194.6607
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Product Description
Catalog Number:
AG01A1KM
Chemical Name:
2-(prop-2-en-1-yl)-1H-1,3-benzodiazole hydrochloride
CAS Number:
1423034-64-3
Molecular Formula:
C10H11ClN2
Molecular Weight:
194.6607
MDL Number:
MFCD22421876
IUPAC Name:
2-prop-2-enyl-1H-benzimidazole;hydrochloride
InChI:
InChI=1S/C10H10N2.ClH/c1-2-5-10-11-8-6-3-4-7-9(8)12-10;/h2-4,6-7H,1,5H2,(H,11,12);1H
InChI Key:
YMKIVXYDIHKPMH-UHFFFAOYSA-N
SMILES:
C=CCc1nc2c([nH]1)cccc2.Cl
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.061g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.662g/mol
Monoisotopic Mass:
194.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties