Home Carboxys 3-Oxoindane-1-carboxylic acid

3-Oxoindane-1-carboxylic acid

CAS No.:
29427-69-8
Catalog Number:
AG002YCY
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%(HPLC)
In Stock USA
United States
$50
- +
1g
98%(HPLC)
In Stock USA
United States
$84
- +
5g
98%(HPLC)
In Stock USA
United States
$198
- +
Product Description
Catalog Number:
AG002YCY
Chemical Name:
3-Oxoindane-1-carboxylic acid
CAS Number:
29427-69-8
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD00092224
IUPAC Name:
3-oxo-1,2-dihydroindene-1-carboxylic acid
InChI:
InChI=1S/C10H8O3/c11-9-5-8(10(12)13)6-3-1-2-4-7(6)9/h1-4,8H,5H2,(H,12,13)
InChI Key:
HXLJFMRZKCSTQD-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(=O)c2c1cccc2
NSC Number:
225078
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.047g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.171g/mol
Monoisotopic Mass:
176.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties