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Home > Nitro Compounds > 95532-74-4
95532-74-4 | 3-Methyl-6-nitrocoumarin 95+%
CAS No: 95532-74-4 Catalog No: AG01FGEC MDL No:
Product Description
Catalog Number:
AG01FGEC
Chemical Name:
3-Methyl-6-nitrocoumarin 95+%
CAS Number:
95532-74-4
IUPAC Name:
3-methyl-6-nitrochromen-2-one
InChI:
InChI=1S/C10H7NO4/c1-6-4-7-5-8(11(13)14)2-3-9(7)15-10(6)12/h2-5H,1H3
InChI Key:
PWANMOIIIMORBV-UHFFFAOYSA-N
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.038g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.169g/mol
Monoisotopic Mass:
205.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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