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185679-91-8

185679-91-8 | 2-Butanone, 4-(1-methyl-1H-indol-3-yl)-4-phenyl-

CAS No: 185679-91-8 Catalog No: AG0076PG MDL No:

Product Description

Catalog Number:
AG0076PG
Chemical Name:
2-Butanone, 4-(1-methyl-1H-indol-3-yl)-4-phenyl-
CAS Number:
185679-91-8
Molecular Formula:
C19H19NO
Molecular Weight:
277.3603
IUPAC Name:
4-(1-methylindol-3-yl)-4-phenylbutan-2-one
InChI:
InChI=1S/C19H19NO/c1-14(21)12-17(15-8-4-3-5-9-15)18-13-20(2)19-11-7-6-10-16(18)19/h3-11,13,17H,12H2,1-2H3
InChI Key:
VAIPVFXXMYDYEP-UHFFFAOYSA-N
SMILES:
CC(=O)CC(c1cn(c2c1cccc2)C)c1ccccc1

Properties

Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.147g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.367g/mol
Monoisotopic Mass:
277.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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