2-Hydroxyoctansure

Hydroxycaprylic Acid

HCID 94180CAS 617-73-2
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
CCCCCCC(O)C(=O)O
InChIKey
JKRDADVRIYVCCY-UHFFFAOYSA-N
Summenformel
C8H16O3
Durchschnittliche Molmasse
160,21 g/mol
Monoisotopische Masse
160,10994437

Namen und Bezeichner

Bevorzugter Name
Hydroxycaprylic Acid
IUPAC
2-hydroxyoctanoic acid
Lokaler Name
2-Hydroxyoctansure
Englischer Name
2-Hydroxycaprylic acid
Summenformel
C8H16O3
Molmasse
160.21

Namen und Synonyme

2-Hydroxyoctanoic acid617-73-22-Hydroxycaprylic acidhydroxycaprylic acidOctanoic acid, 2-hydroxy-alpha-Hydroxycaprylic acidalpha-Hydroxyoctanoic acidDL-2-Hydroxyoctanoic acidDL-2-Hydroxycaprylic acid.alpha.-Hydroxycaprylic acid0R6X0G0S8A.alpha.-Hydroxy-n-caprylic acid
Weitere Namen anzeigen
Hydroxyoctanoic acid2-HYDROXY-N-OCTANOIC ACIDHSDB 83132-hydroxyoctanoate2-hydroxyoctanoicaciA-HYDROXYCAPRYLIC ACID
EINECS 210-524-3NSC 189703NSC-189703alpha-Hydroxy-n-caprylic acidCHEBI:86543DTXSID80862300alpha-HCA acidRefChem:789453

Datenbank-Bezeichner

CAS
617-73-2
PubChem CID
94180
DTXSID
DTXSID80862300
ChEMBL
CHEMBL4447980
ChEBI
CHEBI:86543
UNII
0R6X0G0S8A
EC Number
210-524-3
Nikkaji
J94.836E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2
Polarare Oberfläche (TPSA)
57,5 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
6
Schwere Atome
11

Experimentelle und physikochemische Eigenschaften

Solubility927 mg/mL
Melting Point70 °C
Physical DescriptionSolid

Physikochemische Eigenschaften

Schmelzpunkt
66 · 66-68 °C
Siedepunkt
226.12 °C · 226.12°C (rough estimate)
Dichte
1.0227 · 1.0227 (rough estimate)
Brechungsindex
1.431 · 1.4310 (estimate)
storage temp.
Sealed in dry,Room Temperature
Löslichkeit
Chloroform (Sparingly), Methanol (Slightly)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Regulatory InformationOctanoic acid, 2-hydroxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.8%)

Toxikologische Informationen

Toxicity Summary · 2 Einträge

The CIR Expert Panel concluded that the following ingredients are safe in the present practices of use and concentration described in the safety assessment when formulated to be non-irritating and non-sensitizing, which may be based on a QRA...Hydroxycaprylic Acid...

Safe for use in cosmetics, with qualifications

Regulatorische Informationen

Regulatory InformationOctanoic acid, 2-hydroxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Sicherheitsdaten

wgk
3
hs_code
2918.19.9000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Verwendung und Herstellung

UsesCIR ingredient: Hydroxycaprylic Acid
Household ProductsInformation on 3 consumer products that contain Hydroxycaprylic Acid in the following categories is provided:；• Personal Care
Use ClassificationCosmetics -> Skin conditioning

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Nachgelagerte Produkte

Anbieter50 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: A hydroxy fatty acid that is caprylic (octanoic) acid substituted by a hydroxy group at position 2.

Zugehörige Reaktionen

14
Reaktionsaufzeichnung erstellen

Verknüpfte Notizen

Wird geladen…