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84748-06-1 | 2-Benzofurancarboximidamide,5-chloro-N-hydroxy-3,4,6-trimethyl-
CAS No: 84748-06-1 Catalog No: AG004OYG MDL No:
Product Description
Catalog Number:
AG004OYG
Chemical Name:
2-Benzofurancarboximidamide,5-chloro-N-hydroxy-3,4,6-trimethyl-
CAS Number:
84748-06-1
Molecular Formula:
C12H13ClN2O2
Molecular Weight:
252.6968
IUPAC Name:
5-chloro-N'-hydroxy-3,4,6-trimethyl-1-benzofuran-2-carboximidamide
InChI:
InChI=1S/C12H13ClN2O2/c1-5-4-8-9(6(2)10(5)13)7(3)11(17-8)12(14)15-16/h4,16H,1-3H3,(H2,14,15)
InChI Key:
KWVIKALCNUEIPC-UHFFFAOYSA-N
SMILES:
ONC(=N)c1oc2c(c1C)c(C)c(c(c2)C)Cl
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.067g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.698g/mol
Monoisotopic Mass:
252.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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