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72935-73-0 | 1H-Indole-1-aceticacid, 2,3-dihydro-5-methyl-2-oxo-3,3-diphenyl-
CAS No: 72935-73-0 Catalog No: AG005D1W MDL No:
Product Description
Catalog Number:
AG005D1W
Chemical Name:
1H-Indole-1-aceticacid, 2,3-dihydro-5-methyl-2-oxo-3,3-diphenyl-
CAS Number:
72935-73-0
Molecular Formula:
C23H19NO3
Molecular Weight:
357.4019
IUPAC Name:
2-(5-methyl-2-oxo-3,3-diphenylindol-1-yl)acetic acid
InChI:
InChI=1S/C23H19NO3/c1-16-12-13-20-19(14-16)23(17-8-4-2-5-9-17,18-10-6-3-7-11-18)22(27)24(20)15-21(25)26/h2-14H,15H2,1H3,(H,25,26)
InChI Key:
VRLSINZWMVEPRK-UHFFFAOYSA-N
SMILES:
OC(=O)CN1c2ccc(cc2C(C1=O)(c1ccccc1)c1ccccc1)C
Properties
Complexity:
544
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.136g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
357.409g/mol
Monoisotopic Mass:
357.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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