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10312-55-7 | 2-Aminoterephthalic acid
CAS No: 10312-55-7 Catalog No: AG003909 MDL No:MFCD00134536
Product Description
Catalog Number:
AG003909
Chemical Name:
2-Aminoterephthalic acid
CAS Number:
10312-55-7
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD00134536
IUPAC Name:
2-aminoterephthalic acid
InChI:
InChI=1S/C8H7NO4/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3H,9H2,(H,10,11)(H,12,13)
InChI Key:
GPNNOCMCNFXRAO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)N)C(=O)O
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
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| Water stable Zr-benzenedicarboxylate metal-organic frameworks as photocatalysts for hydrogen generation. | Chemistry (Weinheim an der Bergstrasse, Germany) 20100924 |
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| μ-2-Amino-terephthalato-κO:O-bis-[triphenyl-tin(IV)]. | Acta crystallographica. Section E, Structure reports online 20091101 |
| Two unprecedented porous anionic frameworks: organoammonium templating effects and structural diversification. | Dalton transactions (Cambridge, England : 2003) 20091028 |
| Postsynthetic modifications of iron-carboxylate nanoscale metal-organic frameworks for imaging and drug delivery. | Journal of the American Chemical Society 20091014 |
| Postsynthetic modification: a versatile approach toward multifunctional metal-organic frameworks. | Inorganic chemistry 20090803 |
| 3-D lanthanide metal-organic frameworks: structure, photoluminescence, and magnetism. | Inorganic chemistry 20090202 |
| [Al4(OH)2(OCH3)4(H2N-bdc)3] x xH(2)O: a 12-connected porous metal-organic framework with an unprecedented aluminum-containing brick. | Angewandte Chemie (International ed. in English) 20090101 |
| High-throughput assisted rationalization of the formation of metal organic frameworks in the Iron(III) aminoterephthalate solvothermal system. | Inorganic chemistry 20080901 |
| 2,5-Dicarboxyanilinium chloride monohydrate. | Acta crystallographica. Section C, Crystal structure communications 20061001 |
| Synthesis and cytotoxic activity of substituted 2-phenyl-3-hydroxy-4(1H)-quinolinones-7-carboxylic acids and their phenacyl esters. | European journal of medicinal chemistry 20060401 |
| Prediction of genotoxicity of chemical compounds by statistical learning methods. | Chemical research in toxicology 20050601 |
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