Home Other Building Blocks 2,5,6,7-Tetrahydro-isoindol-4-one

2,5,6,7-Tetrahydro-isoindol-4-one

CAS No.:
113880-79-8
Catalog Number:
AG0009YV
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$223
- +
1g
95%
1 week
United States
$500
- +
Product Description
Catalog Number:
AG0009YV
Chemical Name:
2,5,6,7-Tetrahydro-isoindol-4-one
CAS Number:
113880-79-8
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD05664034
IUPAC Name:
2,5,6,7-tetrahydroisoindol-4-one
InChI:
InChI=1S/C8H9NO/c10-8-3-1-2-6-4-9-5-7(6)8/h4-5,9H,1-3H2
InChI Key:
KFLNDCIGSSBKBA-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1c[nH]c2
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties