Home Carboxys 2-Cyano-1,3-dihydroindene-2-carboxylic acid

2-Cyano-1,3-dihydroindene-2-carboxylic acid

CAS No.:
858226-43-4
Catalog Number:
AG00G9M1
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$250
- +
5g
97%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00G9M1
Chemical Name:
2-Cyano-1,3-dihydroindene-2-carboxylic acid
CAS Number:
858226-43-4
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD21802888
IUPAC Name:
2-cyano-1,3-dihydroindene-2-carboxylic acid
InChI:
InChI=1S/C11H9NO2/c12-7-11(10(13)14)5-8-3-1-2-4-9(8)6-11/h1-4H,5-6H2,(H,13,14)
InChI Key:
NJZOLWVEGIZSOX-UHFFFAOYSA-N
SMILES:
N#CC1(Cc2c(C1)cccc2)C(=O)O
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties