Home Other Building Blocks 1-(1H-indol-3-yl)-2-methylprop-2-en-1-one

1-(1H-indol-3-yl)-2-methylprop-2-en-1-one

CAS No.:
91568-92-2
Catalog Number:
AG01BBDG
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BBDG
Chemical Name:
1-(1H-indol-3-yl)-2-methylprop-2-en-1-one
CAS Number:
91568-92-2
Molecular Formula:
C12H11NO
Molecular Weight:
185.2218
MDL Number:
MFCD15524833
IUPAC Name:
1-(1H-indol-3-yl)-2-methylprop-2-en-1-one
InChI:
InChI=1S/C12H11NO/c1-8(2)12(14)10-7-13-11-6-4-3-5-9(10)11/h3-7,13H,1H2,2H3
InChI Key:
UAXNAAGIMZSAOW-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)c1c[nH]c2c1cccc2
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.226g/mol
Monoisotopic Mass:
185.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties