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Home > Indoles and Oxindole > 1190314-35-2
1190314-35-2 | 1H-Indole, 5,7-dimethyl-4-nitro-
CAS No: 1190314-35-2 Catalog No: AG000HMM MDL No:
Product Description
Catalog Number:
AG000HMM
Chemical Name:
1H-Indole, 5,7-dimethyl-4-nitro-
CAS Number:
1190314-35-2
Molecular Formula:
C10H10N2O2
Molecular Weight:
190.1986
IUPAC Name:
5,7-dimethyl-4-nitro-1H-indole
InChI:
InChI=1S/C10H10N2O2/c1-6-5-7(2)10(12(13)14)8-3-4-11-9(6)8/h3-5,11H,1-2H3
InChI Key:
MTODENNQRUCIFR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)cc(c2c1cc[nH]2)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.202g/mol
Monoisotopic Mass:
190.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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