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39879-60-2 | Methanesulfonic acid, compd. with pyridine (1:1)
CAS No: 39879-60-2 Catalog No: AG00I7TM MDL No:MFCD08460158
Product Description
Catalog Number:
AG00I7TM
Chemical Name:
Methanesulfonic acid, compd. with pyridine (1:1)
CAS Number:
39879-60-2
Molecular Formula:
C6H9NO3S
Molecular Weight:
175.2056
MDL Number:
MFCD08460158
IUPAC Name:
methanesulfonic acid;pyridine
InChI:
InChI=1S/C5H5N.CH4O3S/c1-2-4-6-5-3-1;1-5(2,3)4/h1-5H;1H3,(H,2,3,4)
InChI Key:
BLTAPEIEHGWKKN-UHFFFAOYSA-N
SMILES:
c1cccnc1.CS(=O)(=O)O
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.03g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.202g/mol
Monoisotopic Mass:
175.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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