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29584-88-1 | 1,2-Ethanedisulfonic acid, compd. with 5-isobutyl-4-methylthiazole (1
CAS No: 29584-88-1 Catalog No: AG00BPT8 MDL No:
Product Description
Catalog Number:
AG00BPT8
Chemical Name:
1,2-Ethanedisulfonic acid, compd. with 5-isobutyl-4-methylthiazole (1
CAS Number:
29584-88-1
IUPAC Name:
ethane-1,2-disulfonic acid;4-methyl-5-(2-methylpropyl)-1,3-thiazole
InChI:
InChI=1S/2C8H13NS.C2H6O6S2/c2*1-6(2)4-8-7(3)9-5-10-8;3-9(4,5)1-2-10(6,7)8/h2*5-6H,4H2,1-3H3;1-2H2,(H,3,4,5)(H,6,7,8)
InChI Key:
WKZJSEBQJMMTFQ-UHFFFAOYSA-N
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
500.114g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
500.702g/mol
Monoisotopic Mass:
500.114g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
208A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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