Home Halogens 2-chloro-1-oxo-1H-indene-3-carboxylic acid

2-chloro-1-oxo-1H-indene-3-carboxylic acid

CAS No.:
75639-84-8
Catalog Number:
AG01BC29
Molecular Formula:
C10H5ClO3
Molecular Weight:
208.5979
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Product Description
Catalog Number:
AG01BC29
Chemical Name:
2-chloro-1-oxo-1H-indene-3-carboxylic acid
CAS Number:
75639-84-8
Molecular Formula:
C10H5ClO3
Molecular Weight:
208.5979
MDL Number:
MFCD24482853
IUPAC Name:
2-chloro-3-oxoindene-1-carboxylic acid
InChI:
InChI=1S/C10H5ClO3/c11-8-7(10(13)14)5-3-1-2-4-6(5)9(8)12/h1-4H,(H,13,14)
InChI Key:
PVDUPRDEFJUIKG-UHFFFAOYSA-N
SMILES:
OC(=O)C1=C(Cl)C(=O)c2c1cccc2
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.993g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.597g/mol
Monoisotopic Mass:
207.993g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties