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Home > Indoles and Oxindole > 666174-48-7
666174-48-7 | 1,3-Benzodioxole-5-methanol, 6-(1-methyl-1H-indol-7-yl)-
CAS No: 666174-48-7 Catalog No: AG006JMT MDL No:
Product Description
Catalog Number:
AG006JMT
Chemical Name:
1,3-Benzodioxole-5-methanol, 6-(1-methyl-1H-indol-7-yl)-
CAS Number:
666174-48-7
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
[6-(1-methylindol-7-yl)-1,3-benzodioxol-5-yl]methanol
InChI:
InChI=1S/C17H15NO3/c1-18-6-5-11-3-2-4-13(17(11)18)14-8-16-15(20-10-21-16)7-12(14)9-19/h2-8,19H,9-10H2,1H3
InChI Key:
YMAGZXPVILPRAP-UHFFFAOYSA-N
SMILES:
OCc1cc2OCOc2cc1c1cccc2c1n(C)cc2
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Glycosides of benzodioxole-indole alkaloids from Narcissus having axial chirality. | Phytochemistry 20100201 |
| Galanthindole: a new indole alkaloid from Galanthus plicatus ssp. byzantinus. | Planta medica 20030901 |
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