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Home Aldehydes 1-Isobutyl-1h-indole-3-carbaldehyde

1-Isobutyl-1h-indole-3-carbaldehyde

CAS No.:
433254-46-7
Catalog Number:
AG00DARW
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00DARW
Chemical Name:
1-Isobutyl-1h-indole-3-carbaldehyde
CAS Number:
433254-46-7
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
MDL Number:
MFCD03934494
IUPAC Name:
1-(2-methylpropyl)indole-3-carbaldehyde
InChI:
InChI=1S/C13H15NO/c1-10(2)7-14-8-11(9-15)12-5-3-4-6-13(12)14/h3-6,8-10H,7H2,1-2H3
InChI Key:
FYPAEEAXXGSBFC-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2)CC(C)C
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.269g/mol
Monoisotopic Mass:
201.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Analogues and derivatives of oncrasin-1, a novel inhibitor of the C-terminal domain of RNA polymerase II and their antitumor activities. Journal of medicinal chemistry 20110428
Properties