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646035-19-0 | Acetamide, N-(2-cyano-5-benzothiazolyl)- (9CI)
CAS No: 646035-19-0 Catalog No: AG00EM6M MDL No:
Product Description
Catalog Number:
AG00EM6M
Chemical Name:
Acetamide, N-(2-cyano-5-benzothiazolyl)- (9CI)
CAS Number:
646035-19-0
IUPAC Name:
N-(2-cyano-1,3-benzothiazol-5-yl)acetamide
InChI:
InChI=1S/C10H7N3OS/c1-6(14)12-7-2-3-9-8(4-7)13-10(5-11)15-9/h2-4H,1H3,(H,12,14)
InChI Key:
QLKITAZQRNPYTP-UHFFFAOYSA-N
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.031g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.246g/mol
Monoisotopic Mass:
217.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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