1,11-Undecanedicarboxylic acid - CAS 505-52-2
Catalog: |
BB027111 |
Product Name: |
1,11-Undecanedicarboxylic acid |
CAS: |
505-52-2 |
Synonyms: |
tridecanedioic acid |
IUPAC Name: | tridecanedioic acid |
Description: | 1,11-Undecanedicarboxylic acid (CAS# 505-52-2) is used in the synthesis of two Bis(tetrahydroisoquinoline) which were highly cytotoxic for cancer-cell cultures and less toxic to healthy cells and exhibited noticeable antimicrobial activity against Gram-positive and Gram-negative bacteria and fungal strain Candida albicans. |
Molecular Weight: | 244.33 |
Molecular Formula: | C13H24O4 |
Canonical SMILES: | C(CCCCCC(=O)O)CCCCCC(=O)O |
InChI: | InChI=1S/C13H24O4/c14-12(15)10-8-6-4-2-1-3-5-7-9-11-13(16)17/h1-11H2,(H,14,15)(H,16,17) |
InChI Key: | DXNCZXXFRKPEPY-UHFFFAOYSA-N |
Boiling Point: | 245 ℃ |
Melting Point: | 111 °C |
Purity: | 98 % |
Density: | 1.051 g/cm3 |
Solubility: | Water : 0.01 g/L at 20 ℃ (68 °F) - OECD Test Guideline 105; |
Appearance: | White powder |
MDL: | MFCD00002740 |
LogP: | 3.44670 |
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PMID | Publication Date | Title | Journal |
21810210 | 20110615 | Environment sensing and response mediated by ABC transporters | BMC genomics |
18958453 | 20081201 | Determination of higher carboxylic acids in snow samples using solid-phase extraction and LC/MS-TOF | Analytical and bioanalytical chemistry |
17004808 | 20061005 | Controllable organization of a carboxylic acid type gemini surfactant at different pH values by adding Copper(II) ions | The journal of physical chemistry. B |
15659372 | 20050201 | Crystal structure of the complex formed between a group I phospholipase A2 and a naturally occurring fatty acid at 2.7 A resolution | Protein science : a publication of the Protein Society |
15553784 | 20040901 | [Search for yeast producers of brassylic and sebacic fatty acids] | Prikladnaia biokhimiia i mikrobiologiia |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.16745924 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.16745924 |
Rotatable Bond Count: | 12 |
Topological Polar Surface Area: | 74.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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