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Home > Indoles and Oxindole > 23084-35-7
23084-35-7 | 1H-Indole-3-acetonitrile, 6-methoxy-
CAS No: 23084-35-7 Catalog No: AG002M63 MDL No:MFCD00544228
Product Description
Catalog Number:
AG002M63
Chemical Name:
1H-Indole-3-acetonitrile, 6-methoxy-
CAS Number:
23084-35-7
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00544228
IUPAC Name:
2-(6-methoxy-1H-indol-3-yl)acetonitrile
InChI:
InChI=1S/C11H10N2O/c1-14-9-2-3-10-8(4-5-12)7-13-11(10)6-9/h2-3,6-7,13H,4H2,1H3
InChI Key:
TXDMKKKJRXIVNO-UHFFFAOYSA-N
SMILES:
N#CCc1c[nH]c2c1ccc(c2)OC
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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