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Home > Indoles and Oxindole > 1167056-08-7
1167056-08-7 | 1H-Indole, 4-methoxy-7-methyl-6-nitro-
CAS No: 1167056-08-7 Catalog No: AG000D2J MDL No:
Product Description
Catalog Number:
AG000D2J
Chemical Name:
1H-Indole, 4-methoxy-7-methyl-6-nitro-
CAS Number:
1167056-08-7
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
IUPAC Name:
4-methoxy-7-methyl-6-nitro-1H-indole
InChI:
InChI=1S/C10H10N2O3/c1-6-8(12(13)14)5-9(15-2)7-3-4-11-10(6)7/h3-5,11H,1-2H3
InChI Key:
CCQIOTMJACGJLX-UHFFFAOYSA-N
SMILES:
COc1cc([N+](=O)[O-])c(c2c1cc[nH]2)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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