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Home > Nitro Compounds > 75743-70-3
75743-70-3 | 2H-1-Benzopyran-2-one, 4-hydroxy-3-methoxy-6-nitro-
CAS No: 75743-70-3 Catalog No: AG005ACT MDL No:
Product Description
Catalog Number:
AG005ACT
Chemical Name:
2H-1-Benzopyran-2-one, 4-hydroxy-3-methoxy-6-nitro-
CAS Number:
75743-70-3
Molecular Formula:
C10H7NO6
Molecular Weight:
237.1657
IUPAC Name:
4-hydroxy-3-methoxy-6-nitrochromen-2-one
InChI:
InChI=1S/C10H7NO6/c1-16-9-8(12)6-4-5(11(14)15)2-3-7(6)17-10(9)13/h2-4,12H,1H3
InChI Key:
HIUQGTCZIXIENA-UHFFFAOYSA-N
SMILES:
COc1c(=O)oc2c(c1O)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.167g/mol
Monoisotopic Mass:
237.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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