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Home > Imidazoles > 794468-14-7
794468-14-7 | 4-(1H-imidazol-2-yl)benzene-1-sulfonyl chloride
CAS No: 794468-14-7 Catalog No: AG01DHF9 MDL No:MFCD13177339
Product Description
Catalog Number:
AG01DHF9
Chemical Name:
4-(1H-imidazol-2-yl)benzene-1-sulfonyl chloride
CAS Number:
794468-14-7
Molecular Formula:
C9H7ClN2O2S
Molecular Weight:
242.6821
MDL Number:
MFCD13177339
IUPAC Name:
4-(1H-imidazol-2-yl)benzenesulfonyl chloride
InChI:
InChI=1S/C9H7ClN2O2S/c10-15(13,14)8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H,(H,11,12)
InChI Key:
XNFXZLAUMHVPJQ-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccc(cc1)c1ncc[nH]1
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.992g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.677g/mol
Monoisotopic Mass:
241.992g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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