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Home > Indoles and Oxindole > 25365-84-8
25365-84-8 | 1H-Isoindole, 3-methoxy-1-phenyl-
CAS No: 25365-84-8 Catalog No: AG007NEB MDL No:
Product Description
Catalog Number:
AG007NEB
Chemical Name:
1H-Isoindole, 3-methoxy-1-phenyl-
CAS Number:
25365-84-8
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
3-methoxy-1-phenyl-1H-isoindole
InChI:
InChI=1S/C15H13NO/c1-17-15-13-10-6-5-9-12(13)14(16-15)11-7-3-2-4-8-11/h2-10,14H,1H3
InChI Key:
LTGOWYYXVFBQIH-UHFFFAOYSA-N
SMILES:
COC1=NC(c2c1cccc2)c1ccccc1
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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