Linoleic acid alkyne

CAT: 0931-TN7561-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-TN7561-01Size:10 mg

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CAS Number

1219038-31-9

Target

Others

Related Pathways

Others

Bioactivity

Linoleic acid alkyne, an ω-alkyne derivative of Linoleic acid, serves as a precursor for synthesizing alkyne-containing compounds, including glycerophospholipids, suited for click chemistry applications [1].

Smiles

OC(=O)CCCCCCC\C=C/C\C=C/CCCC#C

Molecular Formula

C18H28O2

Molecular Weight

276.42

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

(9Z,12Z)-Octadeca-9,12-dien-17-ynoic acid

CAS Number	1219038-31-9
PubChem CID	44537819
IUPAC Name	(9Z,12Z)-octadeca-9,12-dien-17-ynoic acid
Molecular Formula	C18H28O2
Molecular Weight	276.4
XLogP	5.5
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	13
Heavy Atom Count	20
Formal Charge	0
Complexity	331

SMILES

C#CCCC/C=C\C/C=C\CCCCCCCC(=O)O

InChI

InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h1,6-7,9-10H,3-5,8,11-17H2,(H,19,20)/b7-6-,10-9-

InChIKey

WPOFIMJJIQUNRW-HZJYTTRNSA-N

Chemical Structure

2D Structure

CAS: 1219038-31-9

CID: 44537819

Formula: C18H28O2

MW: 276.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	276.4
XLogP3	5.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	13
Exact Mass	276.208930132
Monoisotopic Mass	276.208930132
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	331
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T4P2931-01	Linoleic acid
T211426-01	BODIPY-Linoleic acid
T21009-01	Conjugated linoleic acid
T36812-01	Linoleic Acid Amide
T85270-01	Docosahexaenoic Acid Alkyne
T85158-01	Palmitoleic Acid Alkyne
T203812-01	Alkyne-PEG6-acid
T38301	Click N-Acetylmuramic acid - alkyne
T84632-01	9 (E),11 (E) -Conjugated Linoleic Acid
T211210-01	Deoxy-thalidomide-alkyne-hexanoic acid

Alternative Products

Catalog	Name
HY-145469	Linoleic acid alkyne
TBZ0552	Linoleic acid

Linoleic acid alkyne

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