Home Other Building Blocks 1-(2-PROPYNYL)-1H-INDOLE-2,3-DIONE

1-(2-PROPYNYL)-1H-INDOLE-2,3-DIONE

CAS No.:
4290-87-3
Catalog Number:
AG00BZE4
Molecular Formula:
C11H7NO2
Molecular Weight:
185.1788
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00BZE4
Chemical Name:
1-(2-PROPYNYL)-1H-INDOLE-2,3-DIONE
CAS Number:
4290-87-3
Molecular Formula:
C11H7NO2
Molecular Weight:
185.1788
MDL Number:
MFCD00225166
IUPAC Name:
1-prop-2-ynylindole-2,3-dione
InChI:
InChI=1S/C11H7NO2/c1-2-7-12-9-6-4-3-5-8(9)10(13)11(12)14/h1,3-6H,7H2
InChI Key:
MGVPLJCIKWDYKQ-UHFFFAOYSA-N
SMILES:
C#CCN1c2ccccc2C(=O)C1=O
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.048g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.182g/mol
Monoisotopic Mass:
185.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties