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Home > Nitro Compounds > 70292-57-8
70292-57-8 | Benzothiazole, 2-ethoxy-6-nitro- (9CI)
CAS No: 70292-57-8 Catalog No: AG00FJQM MDL No:
Product Description
Catalog Number:
AG00FJQM
Chemical Name:
Benzothiazole, 2-ethoxy-6-nitro- (9CI)
CAS Number:
70292-57-8
IUPAC Name:
2-ethoxy-6-nitro-1,3-benzothiazole
InChI:
InChI=1S/C9H8N2O3S/c1-2-14-9-10-7-4-3-6(11(12)13)5-8(7)15-9/h3-5H,2H2,1H3
InChI Key:
MKANCPQXAHQIFU-UHFFFAOYSA-N
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.234g/mol
Monoisotopic Mass:
224.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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