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172960-62-2 | Metazachlor ethane sulfonic acid
CAS No: 172960-62-2 Catalog No: AG01FO02 MDL No:
Product Description
Catalog Number:
AG01FO02
Chemical Name:
Metazachlor ethane sulfonic acid
CAS Number:
172960-62-2
IUPAC Name:
2-[2,6-dimethyl-N-(pyrazol-1-ylmethyl)anilino]-2-oxoethanesulfonic acid
InChI:
InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)
InChI Key:
IPVCSECPEVHQOV-UHFFFAOYSA-N
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.094g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.367g/mol
Monoisotopic Mass:
323.094g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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