Methyl palmitoleate

HCID 643801
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Basic information

CAS
1120-25-8
Standard SMILES
CCCCCC/C=C\CCCCCCCC(=O)OC
InChIKey
IZFGRAGOVZCUFB-HJWRWDBZSA-N
Molecular formula
C17H32O2
Average molar mass
268.4 g/mol
Monoisotopic mass
268.24023026

Names & identifiers

Preferred name
Methyl palmitoleate
IUPAC
methyl (Z)-hexadec-9-enoate
English name
PALMITOLEIC ACID METHYL ESTER
Molecular formula
C17H32O2
Molecular weight
268.43

Names & synonyms

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

Database identifiers

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

Properties

Computed structural properties

XLogP
6.5
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
14
Heavy atoms
19

Experimental & physicochemical properties

Kovats Retention Index · 3 items

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

Physicochemical properties

Melting point
-0.5 · -0.5-0.5 °C (lit.)
Boiling point
180 · 180-183 °C/1 mmHg (lit.)
Density
0.875 g/mL · 0.875 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.451(lit.)
Flash point
113 °C · 113 °C
storage temp.
-20 °C · -20°C

Safety & regulation

GHS classification

GHS Classification · 6 items

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.

Hazard information

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

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
1
hs_code
29161900
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications · 3 items

DescriptionPalmitoleic 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.

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

General DescriptionMethyl palmitoleate is a major component of biodiesel having low temperature property, which is found to be more advantageous than methyl oleate.

Preparation methods

PreparationPALMITOLEIC ACID METHYL ESTER can be prepared by a condensation reaction of palmitoleic acid and trimethyl orthoformate.

Upstream & downstream products

Suppliers100 total

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]

Additional notes

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

Related reactions

1 records
New reaction record

Compound notes

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