(+-)-3-Hydroxydodecanoic acid

HCID 94216CAS 1883-13-2
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
CCCCCCCCCC(O)CC(=O)O
InChIKey
MUCMKTPAZLSKTL-UHFFFAOYSA-N
Summenformel
C12H24O3
Durchschnittliche Molmasse
216,32 g/mol
Monoisotopische Masse
216,17254463

Überblick

3-hydroxylauric acid is a medium-chain fatty acid that is the 3-hydroxylated derivative of lauric acid; associated with fatty acid metabolic disorders. It is a medium-chain fatty acid and a 3-hydroxy fatty acid. It is functionally related to a dodecanoic acid. It is a conjugate acid of a 3-hydroxylaurate.

Namen und Bezeichner

Bevorzugter Name
(+-)-3-Hydroxydodecanoic acid
IUPAC
3-hydroxydodecanoic acid
Englischer Name
3-Hydroxydodecanoic acid
Summenformel
C12H24O3
Molmasse
216.32

Namen und Synonyme

3-Hydroxydodecanoic acid1883-13-23-Hydroxylauric acidDodecanoic acid, 3-hydroxy-3-hydroxy-dodecanoic acidCHEBI:36206DTXSID70862773RefChem:502554(+-)-3-Hydroxydodecanoic acidDTXCID80811494beta-Hydroxylauric acid3-hydroxy lauric acid
Weitere Namen anzeigen
3-hydroxylauricaci3-HYDROXY C12:0 ACIDDL-β-Hydroxylauric acidDL-2-Hydroxylauric acidDodecanoic acid,3-hydroxy-DL-BETA-HYDROXYLAURIC ACID3-Hydroxydodecanoic acid, 98 %(+/-)-3-HYDROXYDODECANOIC ACID
53941-38-1MFCD001332793-OH lauric acid3-OH dodecanoic acidbeta-OH dodecanoic acidbeta-Hydroxydodecanoic acidGTPL5850CHEMBL4288936

Datenbank-Bezeichner

CAS
1883-13-2
PubChem CID
94216
DTXSID
DTXSID70862773
ChEMBL
CHEMBL4288936
ChEBI
CHEBI:36206
UNII
JA9VER34Z8
EC Number
808-499-4
Nikkaji
J111.042J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,6
Polarare Oberfläche (TPSA)
57,5 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
10
Schwere Atome
15

Experimentelle und physikochemische Eigenschaften

LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Hydroxy fatty acids [FA0105]

Physikochemische Eigenschaften

Schmelzpunkt
70 · 70-70.5 °C
Siedepunkt
113 · 113-115 °C(Press: 3 Torr)
Dichte
0.987 · 0.987±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
Löslichkeit
Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand
Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

wgk
3
risk_code
22
hazard_code
Xn
Speicherklasse
11 - Combustible Solids
Hazard Classifications
Acute Tox. 4 Oral

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden3-hydroxydodecanoic acid is used in the study of Lipid A, a major constituent of the lipopolysaccharides, which are responsible for the toxicity of gram negative bacteria. Also used in the synthesis of olefins from β-hydroxy carboxylic acids.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

Anbieter50 Anbieter

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: A medium-chain fatty acid that is the 3-hydroxylated derivative of lauric acid; associated with fatty acid metabolic disorders.

Zugehörige Reaktionen

4
Reaktionsaufzeichnung erstellen

Verknüpfte Notizen

Wird geladen…