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Home > Nitro Compounds > 60357-78-0
60357-78-0 | 1,2-Benzisoxazol-3(2H)-one, 7-nitro-
CAS No: 60357-78-0 Catalog No: AG00IAOX MDL No:MFCD28663329
Product Description
Catalog Number:
AG00IAOX
Chemical Name:
1,2-Benzisoxazol-3(2H)-one, 7-nitro-
CAS Number:
60357-78-0
MDL Number:
MFCD28663329
IUPAC Name:
7-nitro-1,2-benzoxazol-3-one
InChI:
InChI=1S/C7H4N2O4/c10-7-4-2-1-3-5(9(11)12)6(4)13-8-7/h1-3H,(H,8,10)
InChI Key:
USIDBICZJTWOCD-UHFFFAOYSA-N
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.119g/mol
Monoisotopic Mass:
180.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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