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Home > Nitro Compounds > 59528-35-7
59528-35-7 | 6-Methoxy-2-(3,4-methylenedioxyphenyl)-3-nitro-2H-1-benzopyran
CAS No: 59528-35-7 Catalog No: AG00F2CY MDL No:
Product Description
Catalog Number:
AG00F2CY
Chemical Name:
6-Methoxy-2-(3,4-methylenedioxyphenyl)-3-nitro-2H-1-benzopyran
CAS Number:
59528-35-7
IUPAC Name:
2-(1,3-benzodioxol-5-yl)-6-methoxy-3-nitro-2H-chromene
InChI:
InChI=1S/C17H13NO6/c1-21-12-3-5-14-11(6-12)7-13(18(19)20)17(24-14)10-2-4-15-16(8-10)23-9-22-15/h2-8,17H,9H2,1H3
InChI Key:
PUEHCRFBJIAKTB-UHFFFAOYSA-N
Properties
Complexity:
518
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.074g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.292g/mol
Monoisotopic Mass:
327.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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