Dodecanedioic acid - CAS 693-23-2
Catalog: |
BB033772 |
Product Name: |
Dodecanedioic acid |
CAS: |
693-23-2 |
Synonyms: |
dodecanedioic acid |
Application: |
Used as intermediate for plasticizers, lubricants, adhesives, polyesters, and others. |
IUPAC Name: | dodecanedioic acid |
Description: | Induced mutation of dodecanedioic acid producing Candida tropicalis. Used in cosmetic compositions. |
Molecular Weight: | 230.30 |
Molecular Formula: | C12H22O4 |
Canonical SMILES: | C(CCCCCC(=O)O)CCCCC(=O)O |
InChI: | InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16) |
InChI Key: | TVIDDXQYHWJXFK-UHFFFAOYSA-N |
Boiling Point: | 245 °C / 10 mmHg |
Melting Point: | 127-129 °C |
Flash Point: | 220 °C (C.C) |
Purity: | 99 % |
Density: | 1.15 g/cm3 |
Solubility: | Sol in hot toluene, Alc, Hot acetic acid; slightly sol in hot water |
Appearance: | White to almost white powder to crystal |
MDL: | MFCD00002735 |
LogP: | 3.05660 |
GHS Hazard Statement: | H315 (11.14%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3763769-A1 | Method for preparing copolyamide resin and copolyamide hot-melt yarn | 20201109 |
US-10934384-B1 | Polyurethane elastomer compositions, and processes thereof | 20200909 |
US-10934385-B1 | Polyurethane elastomers, bio-additive foam compositions | 20200909 |
US-11028217-B1 | Thermoplastic polyurethane compositions comprising nitro-substituted polyester diols | 20200313 |
EP-3842409-A1 | Method and system for refining long chain dicarboxylic acid | 20191224 |
PMID | Publication Date | Title | Journal |
29658313 | 20181201 | Metabonomic analysis of toxic action of long-term low-level exposure to acrylamide in rat serum | Human & experimental toxicology |
22998979 | 20121015 | Effect of ginseng polysaccharide on the urinary excretion of type 2 diabetic rats studied by liquid chromatography-mass spectrometry | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences |
22548090 | 20120101 | Occupational asthma: new low-molecular-weight causal agents, 2000-2010 | Journal of allergy |
21810210 | 20110615 | Environment sensing and response mediated by ABC transporters | BMC genomics |
21289408 | 20110311 | The role of surface charge on the uptake and biocompatibility of hydroxyapatite nanoparticles with osteoblast cells | Nanotechnology |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 230.15180918 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 230.15180918 |
Rotatable Bond Count: | 11 |
Topological Polar Surface Area: | 74.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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