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Home > Indoles and Oxindole > 109103-45-9
109103-45-9 | 1H-Indole-2,3-dione, 5-methoxy-, 3-oxime
CAS No: 109103-45-9 Catalog No: AG007TO3 MDL No:MFCD01055848
Product Description
Catalog Number:
AG007TO3
Chemical Name:
1H-Indole-2,3-dione, 5-methoxy-, 3-oxime
CAS Number:
109103-45-9
Molecular Formula:
C9H8N2O3
Molecular Weight:
192.1714
MDL Number:
MFCD01055848
IUPAC Name:
5-methoxy-3-nitroso-1H-indol-2-ol
InChI:
InChI=1S/C9H8N2O3/c1-14-5-2-3-7-6(4-5)8(11-13)9(12)10-7/h2-4,10,12H,1H3
InChI Key:
QFJMAJZTMLXACD-UHFFFAOYSA-N
SMILES:
ON=C1C(=O)Nc2c1cc(OC)cc2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.053g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.174g/mol
Monoisotopic Mass:
192.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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