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Home > Nitro Compounds > 1356087-69-8
1356087-69-8 | 3-(5-Nitro-1H-indazol-3-yl)benzonitrile
CAS No: 1356087-69-8 Catalog No: AG00HU8P MDL No:
Product Description
Catalog Number:
AG00HU8P
Chemical Name:
3-(5-Nitro-1H-indazol-3-yl)benzonitrile
CAS Number:
1356087-69-8
IUPAC Name:
3-(5-nitro-1H-indazol-3-yl)benzonitrile
InChI:
InChI=1S/C14H8N4O2/c15-8-9-2-1-3-10(6-9)14-12-7-11(18(19)20)4-5-13(12)16-17-14/h1-7H,(H,16,17)
InChI Key:
TXBYUOPNJJOAHI-UHFFFAOYSA-N
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.065g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.244g/mol
Monoisotopic Mass:
264.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
98.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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