Home Carboxys 1,7-dihydroxynaphthalene-2-carboxylic acid

1,7-dihydroxynaphthalene-2-carboxylic acid

CAS No.:
86699-99-2
Catalog Number:
AG01B7EM
Molecular Formula:
C11H8O4
Molecular Weight:
204.1788
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Product Description
Catalog Number:
AG01B7EM
Chemical Name:
1,7-dihydroxynaphthalene-2-carboxylic acid
CAS Number:
86699-99-2
Molecular Formula:
C11H8O4
Molecular Weight:
204.1788
MDL Number:
MFCD24479927
IUPAC Name:
1,7-dihydroxynaphthalene-2-carboxylic acid
InChI:
InChI=1S/C11H8O4/c12-7-3-1-6-2-4-8(11(14)15)10(13)9(6)5-7/h1-5,12-13H,(H,14,15)
InChI Key:
ZCHMTTBBZBUJMA-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c(O)c(cc2)C(=O)O
Properties
Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.042g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
204.181g/mol
Monoisotopic Mass:
204.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties