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100211-96-9 | Benzoic acid, 2-hydroxy-5-[[(2-hydroxyphenyl)methylene]amino]-
CAS No: 100211-96-9 Catalog No: AG00019E MDL No:
Product Description
Catalog Number:
AG00019E
Chemical Name:
Benzoic acid, 2-hydroxy-5-[[(2-hydroxyphenyl)methylene]amino]-
CAS Number:
100211-96-9
Molecular Formula:
C14H11NO4
Molecular Weight:
257.2414
IUPAC Name:
2-hydroxy-5-[(2-hydroxyphenyl)methylideneamino]benzoic acid
InChI:
InChI=1S/C14H11NO4/c16-12-4-2-1-3-9(12)8-15-10-5-6-13(17)11(7-10)14(18)19/h1-8,16-17H,(H,18,19)
InChI Key:
BICCUOGEUODANY-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C=Nc1ccc(c(c1)C(=O)O)O
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.069g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
257.245g/mol
Monoisotopic Mass:
257.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
90.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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