3-Decanol

HCID 519158CAS 1565-81-7
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Grundinformationen

Standard-SMILES
CCCCCCCC(O)CC
InChIKey
ICEQLCZWZXUUIJ-UHFFFAOYSA-N
Summenformel
C10H22O
Durchschnittliche Molmasse
158,28 g/mol
Monoisotopische Masse
158,16706532

Überblick

Decan-3-ol is a secondary alcohol that is decane substituted by a hydroxy group at position 3. It has a role as an Arabidopsis thaliana metabolite, a pheromone, a flavouring agent and an animal metabolite. It is a decanol and a secondary alcohol.

Namen und Bezeichner

Bevorzugter Name
3-Decanol
IUPAC
decan-3-ol
Englischer Name
3-DECANOL
Summenformel
C10H22O
Molmasse
158.28

Namen und Synonyme

3-Decanoldecan-3-olEthyl heptyl carbinolHeptyl ethyl carbinolEthyl n-heptyl carbinol3-HYDROXYDECANEFEMA No. 3605UNII-WTY84QBP4TWTY84QBP4TDL-DECAN-3-OL3-DECANOL [FHFI]1-ETHYL-1-OCTANOL
Weitere Namen anzeigen
3-Decanoi3-Decanol>3-HYDROXYDECANE3-DECYL ALCOHOLETHYLHEPTYLCARBINOLETHYL-N-HEPTYLCARBINOL3-Decyl Alcohol Ethylheptylcarbinol
AI3-19948DTXSID50862695FEMA 3605RefChem:93621(+-)-3-DECANOLDTXCID908114253-DECANOL, (+-)-605-062-8

Datenbank-Bezeichner

CAS
1565-81-7
PubChem CID
519158
DTXSID
DTXSID50862695
ChEBI
CHEBI:195405
UNII
WTY84QBP4T
EC Number
605-062-8
Nikkaji
J80.234D

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,9
Polarare Oberfläche (TPSA)
20,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
7
Schwere Atome
11

Experimentelle und physikochemische Eigenschaften

LipidsFatty Acyls [FA] -> Fatty alcohols [FA05]
SolventsSolvents -> Alcohols (<C12)
SpringerMaterials PropertiesDensity
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.826-0.832
Flavoring AgentsEU Flavoring substances

Physikochemische Eigenschaften

Schmelzpunkt
-5 °C · -5°C
Siedepunkt
98 · 98-99°C 11mm
Dichte
0 · 0,83 g/cm3
Brechungsindex
1.4345 · 1.4345
FEMA
3605 · 3605 | 3-DECANOL
Flammpunkt
99 °C · 99°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Not Classified

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: 3-Decanol

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

3-Decanol: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazards SummarySafe when used as a flavoring agent in food; [JECFA] An irritant; [Alfa Aesar MSDS] See 1-Decanol.
Hazard Classes and CategoriesEye Irrit. 2 (100%)

Toxikologische Informationen

Adverse EffectsNeurotoxin - Acute solvent syndrome

Sicherheitsdaten

wgk
WGK 3
tsca
TSCA listed
risk_code
36/37/38-20/21/22
hazard_code
Xn,Xi
safety_code
26-37-37/39-36
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Verwendung und Herstellung

UsesUsed as flavoring agent or adjuvant; [FDA]
Use Classification · 3 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing Information3-Decanol: ACTIVE

Anwendungen

OccurrenceReported found in mint, French fried potato and spearmint oil.

Anbieter49 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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