Home Carboxys (2Z)-2-Benzylidene-1,3-dioxoindane-5-carboxylic acid

(2Z)-2-Benzylidene-1,3-dioxoindane-5-carboxylic acid

CAS No.:
40462-12-2
Catalog Number:
AG0077B6
Molecular Formula:
C17H10O4
Molecular Weight:
278.2589
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG0077B6
Chemical Name:
(2Z)-2-Benzylidene-1,3-dioxoindane-5-carboxylic acid
CAS Number:
40462-12-2
Molecular Formula:
C17H10O4
Molecular Weight:
278.2589
MDL Number:
MFCD03066704
IUPAC Name:
2-benzylidene-1,3-dioxoindene-5-carboxylic acid
InChI:
InChI=1S/C17H10O4/c18-15-12-7-6-11(17(20)21)9-13(12)16(19)14(15)8-10-4-2-1-3-5-10/h1-9H,(H,20,21)
InChI Key:
KAAZONMQZCIBTC-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)C(=O)/C(=C\c1ccccc1)/C2=O
Properties
Complexity:
499  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.058g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.263g/mol
Monoisotopic Mass:
278.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3  
Properties