Home Carboxys 1-hydroxy-1H-indene-2-carboxylic acid

1-hydroxy-1H-indene-2-carboxylic acid

CAS No.:
28873-82-7
Catalog Number:
AG01BJ7E
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
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Product Description
Catalog Number:
AG01BJ7E
Chemical Name:
1-hydroxy-1H-indene-2-carboxylic acid
CAS Number:
28873-82-7
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD20644058
IUPAC Name:
1-hydroxy-1H-indene-2-carboxylic acid
InChI:
InChI=1S/C10H8O3/c11-9-7-4-2-1-3-6(7)5-8(9)10(12)13/h1-5,9,11H,(H,12,13)
InChI Key:
PNHVOGBNJHACNI-UHFFFAOYSA-N
SMILES:
OC(=O)C1=Cc2c(C1O)cccc2
Properties
Complexity:
257  
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:
2  
Isotope Atom Count:
0
Molecular Weight:
176.171g/mol
Monoisotopic Mass:
176.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties