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Home > Nitro Compounds > 677335-32-9
677335-32-9 | 4-hydroxy-3-methoxy-2-nitrobenzonitrile
CAS No: 677335-32-9 Catalog No: AG00G1KJ MDL No:
Product Description
Catalog Number:
AG00G1KJ
Chemical Name:
4-hydroxy-3-methoxy-2-nitrobenzonitrile
CAS Number:
677335-32-9
IUPAC Name:
4-hydroxy-3-methoxy-2-nitrobenzonitrile
InChI:
InChI=1S/C8H6N2O4/c1-14-8-6(11)3-2-5(4-9)7(8)10(12)13/h2-3,11H,1H3
InChI Key:
HEMPYISMRTXHJH-UHFFFAOYSA-N
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.146g/mol
Monoisotopic Mass:
194.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
99.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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