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125564-43-4

125564-43-4 | 1H-Indene-5-acetic acid, 2,3-dihydro-1-oxo-

CAS No: 125564-43-4 Catalog No: AG000NW6 MDL No:

Product Description

Catalog Number:
AG000NW6
Chemical Name:
1H-Indene-5-acetic acid, 2,3-dihydro-1-oxo-
CAS Number:
125564-43-4
Molecular Formula:
C11H10O3
Molecular Weight:
190.1953
IUPAC Name:
2-(1-oxo-2,3-dihydroinden-5-yl)acetic acid
InChI:
InChI=1S/C11H10O3/c12-10-4-2-8-5-7(6-11(13)14)1-3-9(8)10/h1,3,5H,2,4,6H2,(H,13,14)
InChI Key:
XDFIZPRBAFKLGK-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc2c(c1)CCC2=O

Properties

Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.198g/mol
Monoisotopic Mass:
190.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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