Oct-3-ensure

3-Octenoic acid

HCID 15307
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Grundinformationen

CAS
1577-19-1
Standard-SMILES
CCCCC=CCC(=O)O
InChIKey
IWPOSDLLFZKGOW-UHFFFAOYSA-N
Summenformel
C8H14O2
Durchschnittliche Molmasse
142,2 g/mol
Monoisotopische Masse
142,09937969

Namen und Bezeichner

Bevorzugter Name
3-Octenoic acid
IUPAC
oct-3-enoic acid
Lokaler Name
Oct-3-ensure
Englischer Name
3-Octenoic acid
Summenformel
C8H14O2
Molmasse
142.2

Namen und Synonyme

DTXSID006179952M4D39OOYRefChem:855405DTXCID7035068FEMA NO. 43622-HEPTENE-1-CARBOXYLIC ACID216-418-31577-19-13-Octenoic acidoct-3-enoic acidoct-3-enoicacidMFCD00016562
Weitere Namen anzeigen
Octenoicacid3-OctenoicAcid>3-OCTENOIC ACID 95+%TRANS-3-OCTENOIC ACID3-OCTENOIC ACID TECH 85%3-Octenoic acid, tech. 85%
SCHEMBL586011IWPOSDLLFZKGOW-UHFFFAOYSA-N

Datenbank-Bezeichner

CAS
1577-19-1
PubChem CID
15307
DTXSID
DTXSID0061799
EC Number
216-418-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,3
Polarare Oberfläche (TPSA)
37,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
5
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

Density0.928-0.938 (20 °C)
Solubility · 2 Einträge

Slightly soluble in water; soluble in most organic solvents

Soluble (in ethanol)

Boiling Point240-242 °C
Refractive Index1.443-1.450
Physical DescriptionWhite solid; Oily, fatty aroma

Physikochemische Eigenschaften

Schmelzpunkt
1.7 °C · 1.7°C (estimate)
Siedepunkt
237 · 237-240°C
Dichte
0.9565 · 0.9565 (rough estimate)
FEMA
4362 · 4362 | 3-OCTENOIC ACID
Brechungsindex
1.442 · 1.4420-1.4470
Flammpunkt
110 °C · >110 °C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (46.8%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 79 reports by companies from 3 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 Information3-Octenoic acid: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Corr. 1C (100%)；Eye Dam. 1 (46.8%)

Regulatorische Informationen

Regulatory Information3-Octenoic acid: Does not have an individual approval but may be used under an appropriate group standard

Sicherheitsdaten

tsca
TSCA listed
ridadr
3265
hs_code
2916.19.3000
risk_code
34
hazard_code
C
safety_code
26-36/37/39-45

Chemie und Industrie

Verwendung und Herstellung

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-Octenoic acid: ACTIVE

Anbieter26 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]

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