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Home > Nitro Compounds > 57543-83-6
57543-83-6 | 3-Nitro-2,6,7-trimethyl-2H-1-benzopyran
CAS No: 57543-83-6 Catalog No: AG00F16U MDL No:
Product Description
Catalog Number:
AG00F16U
Chemical Name:
3-Nitro-2,6,7-trimethyl-2H-1-benzopyran
CAS Number:
57543-83-6
IUPAC Name:
2,6,7-trimethyl-3-nitro-2H-chromene
InChI:
InChI=1S/C12H13NO3/c1-7-4-10-6-11(13(14)15)9(3)16-12(10)5-8(7)2/h4-6,9H,1-3H3
InChI Key:
DRQBSLQRAKLDGC-UHFFFAOYSA-N
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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