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82-07-5 | 9H-Xanthene-9-carboxylic acid
CAS No: 82-07-5 Catalog No: AG003VC1 MDL No:MFCD00005059
Product Description
Catalog Number:
AG003VC1
Chemical Name:
9H-Xanthene-9-carboxylic acid
CAS Number:
82-07-5
Molecular Formula:
C14H10O3
Molecular Weight:
226.2274
MDL Number:
MFCD00005059
IUPAC Name:
9H-xanthene-9-carboxylic acid
InChI:
InChI=1S/C14H10O3/c15-14(16)13-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)13/h1-8,13H,(H,15,16)
InChI Key:
VSBFNCXKYIEYIS-UHFFFAOYSA-N
SMILES:
OC(=O)C1c2ccccc2Oc2c1cccc2
EC Number:
201-394-9
UNII:
63A81F6A8V
NSC Number:
66208
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.063g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.231g/mol
Monoisotopic Mass:
226.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Adhesion of Ferroplasma acidiphilum onto pyrite calculated from the extended DLVO theory using the van Oss-Good-Chaudhury approach. | Journal of colloid and interface science 20100915 |
| Synthesis of some new mono- and bis-polycyclic aromatic spiro and bis-nonspiro-beta-lactams. | Molecules (Basel, Switzerland) 20100122 |
| Predicting enzyme targets for cancer drugs by profiling human metabolic reactions in NCI-60 cell lines. | BMC bioinformatics 20100101 |
| Synthesis, crystal structures, and photophysical properties of homodinuclear lanthanide xanthene-9-carboxylates. | Inorganic chemistry 20071224 |
| Pathway aberrations of murine melanoma cells observed in Paired-End diTag transcriptomes. | BMC cancer 20070101 |
| Precision improvement for the analysis of flavonoids in selected Thai plants by capillary zone electrophoresis. | Electrophoresis 20050201 |
| A stability-indicating proton nuclear magnetic resonance spectroscopic method for the analysis of propantheline bromide in pharmaceutical samples. | Die Pharmazie 20010901 |
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