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Home > Nitro Compounds > 57543-79-0
57543-79-0 | 8-Methoxy-2-methyl-3-nitro-2H-1-benzopyran
CAS No: 57543-79-0 Catalog No: AG00F16S MDL No:
Product Description
Catalog Number:
AG00F16S
Chemical Name:
8-Methoxy-2-methyl-3-nitro-2H-1-benzopyran
CAS Number:
57543-79-0
IUPAC Name:
8-methoxy-2-methyl-3-nitro-2H-chromene
InChI:
InChI=1S/C11H11NO4/c1-7-9(12(13)14)6-8-4-3-5-10(15-2)11(8)16-7/h3-7H,1-2H3
InChI Key:
SHCOTMVNOXWXRY-UHFFFAOYSA-N
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.212g/mol
Monoisotopic Mass:
221.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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