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1480960-79-9 | (1-methyl-1H-imidazol-5-yl)methanesulfonyl chloride
CAS No: 1480960-79-9 Catalog No: AG01B3A4 MDL No:MFCD21699554
Product Description
Catalog Number:
AG01B3A4
Chemical Name:
(1-methyl-1H-imidazol-5-yl)methanesulfonyl chloride
CAS Number:
1480960-79-9
Molecular Formula:
C5H7ClN2O2S
Molecular Weight:
194.6393
MDL Number:
MFCD21699554
IUPAC Name:
(3-methylimidazol-4-yl)methanesulfonyl chloride
InChI:
InChI=1S/C5H7ClN2O2S/c1-8-4-7-2-5(8)3-11(6,9)10/h2,4H,3H2,1H3
InChI Key:
MDVSWGQSLCMZGO-UHFFFAOYSA-N
SMILES:
Cn1cncc1CS(=O)(=O)Cl
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.992g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.633g/mol
Monoisotopic Mass:
193.992g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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