Methyl palmitoleate (HCID 643801)

名称と識別子

優先名称: Methyl palmitoleate
IUPAC: methyl (Z)-hexadec-9-enoate
現地名: (Z)-9-ヘキサデセン酸メチル
英語名: PALMITOLEIC ACID METHYL ESTER
分子式: C17H32O2
分子量: 268.43

名称と別名

METHYL PALMITOLEATE1120-25-8Methyl (Z)-hexadec-9-enoatemethyl (9Z)-hexadec-9-enoatePalmitoleic acid methyl esterCHEBI:84156DTXSID0089735135695QDB9FRefChem:818015DTXCID301326715214-303-2(Z)-Methyl hexadec-9-enoate

名称をさらに表示

パルミトオレイン酸メチル(9Z)-9-ヘキサデセン酸メチルパルミトレイン酸メチル(Z)-9-ヘキサデセン酸メチル9-ヘキサデセン酸,メチルエステルcis-9-ヘキサデセン酸メチルメチル＝（Z）-ヘキサデカ-9-エノアートCIS‐9‐ヘキサデセン酸メチル標準品パルミトレイン酸メチルエステルCIS-9-ヘキサデセン酸メチル STANDARDcis-9-ヘキサデセン酸メチル Standard, 10.0 mg/mL in Heptaneメチル (9Z)-ヘキサデカ-9-エノアートｃｉｓ-9-ヘキサデセン酸メチル標準品パルミトレイン酸メチル標準品CIS-9-HEXADECENOIC ACID METHYL ESTERmethyl palmitioleatePalm oil methyl esterPalmitoleic acid methylMethyl cis-palmitoleate9-Hexadecenoicacid,methylMethyl (9Z)-hexadecenoate

Methyl cis-9-hexadecenoate9-Hexadecenoic acid, methyl ester, (Z)-Palmitoleic acid-methyl esterMethyl palmitoleinatePalmitoleic acid, methyl esterMethyl Z-9-hexadecenoateMFCD00042911Methyl cis-hexadec-9-enoate

データベース識別子

CAS: 1120-25-8
PubChem CID: 643801
DTXSID: DTXSID00897351
ChEBI: CHEBI:84156
UNII: 35695QDB9F
EC Number: 214-303-2
Nikkaji: J47.591B

物性

構造計算による物性

XLogP: 6.5
極性表面積: 26.3 Å²
水素結合供与体数: 0
水素結合受容体数: 2
回転可能結合数: 14
重原子数: 19
形式電荷: 0
複雑度: 221

実験および物理化学的性質

Kovats Retention Index · 3 件

1885.86；1881；1884；1896；1888；1889；1895；1882；1886；1887.5

1911.7；1932；1912；1879；1890；1898.1；1894.1；1900.1

2225；2242；2277；2236；2237；2245

物理化学的性質

融点: -0.5 · -0.5-0.5 °C (lit.)
沸点: 180 · 180-183 °C/1 mmHg (lit.)
比重(密度): 0.875 g/mL · 0.875 g/mL at 25 °C (lit.)
屈折率: 20 · n20/D 1.451(lit.)
闪点: 113 °C · 113 °C
貯蔵温度: -20 °C · -20°C
溶解性: クロロホルム（微量）、メタノール（微量）
外見: 液体
色: 無色
由来生物: Macadamia integrifolia oil
BRN: 1726111 · 1726111
安定性: Light sensitive
InChI: 1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h8-9H,3-7,10-16H2,1-2H3/b9-8-
InChIKey: IZFGRAGOVZCUFB-HJWRWDBZSA-N
SMILES: CCCCCC\C=C/CCCCCCCC(=O)OC
LogP: 6.999 · 6.999 (est)
CAS データベース: 1120 · 1120-25-8

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 66.7% (4 of 6) of all reports.

Warning

H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (33.3%): 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 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 4 of 6 reports by companies.；There are 2 notifications provided by 2 of 6 reports by companies with hazard statement code(s).；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.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)；Eye Irrit. 2 (33.3%)；STOT SE 3 (33.3%)

安全データ

wgk: 1
hs_code: 29161900
risk_code: 36/37/38
化審法: (2)-798
消防法: 危-4-3-III
hazard_code: Xi
safety_code: 26-36/37
ストレージクラス: 10 - Combustible liquids

化学と産業

応用分野 · 3 件

説明Palmitoleic acid methyl ester is an ester version of palmitoleic acid , an ω-7 monounsaturated fatty acid that is a common constituent of the triglycerides of human adipose tissue. Palmitoleic acid-based diets raise low-density lipoprotein (LDL) cholesterol and lower high-density lipoprotein (HDL) cholesterol, even when dietary intake of cholesterol is maintained at a low level. Methyl esters of fatty acids are commonly used for the formulation of fatty acid-containing diets and dietary supplements.

使用Methyl Palmitoleate is used as a component in the preparation of a biodiesel fuels.

一般的な説明Methyl palmitoleate is a major component of biodiesel having low temperature property, which is found to be more advantageous than methyl oleate.

上流・下流製品情報

下流製品

CIS‐7,10,13,16,19‐ドコサペンタエン酸メチル標準品

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]

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]

湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]

上海毕合生物化学技术有限公司13816464724 · [email protected]

補足説明

定義ChEBI: A fatty acid methyl ester obtained from the formal condensation of methanol and palmitoleic acid.

(Z)-9-ヘキサデセン酸メチル

基本情報