8,11-Eicosadiynoic Acid

CAT: 0024-sc-205179Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-205179Size:1 mg

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CAS Number

82073-91-4

Chemical Information

8,11-Eicosadiynoic acid

8,11-eicosadiynoic acid is a long-chain fatty acid.

CAS Number	82073-91-4
PubChem CID	1899
IUPAC Name	icosa-8,11-diynoic acid
Molecular Formula	C20H32O2
Molecular Weight	304.5
XLogP	7.4
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	12
Heavy Atom Count	22
Formal Charge	0
Complexity	396

SMILES

CCCCCCCCC#CCC#CCCCCCCC(=O)O

InChI

InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-8,11,14-19H2,1H3,(H,21,22)

InChIKey

AJBBHZDIKZCZAI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 82073-91-4

CID: 1899

Formula: C20H32O2

MW: 304.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	304.5
XLogP3	7.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	12
Exact Mass	304.240230259
Monoisotopic Mass	304.240230259
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	396
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-221152	8,11,14-Eicosatriynoic Acid
sc-221152A	8,11,14-Eicosatriynoic Acid
sc-507132	5,7-Eicosadiynoic acid
sc-507127	Cis-11,14-Eicosadienoic acid
sc-498741	(Z, Z) -5,11-Eicosadienoic acid
sc-251602	1,4,8,11-Tetraazacyclotetradecane-1,4,8,11-tetraacetic acid tetrahydrochloride tetrahydrate
sc-497395	Cis-8,11,14-Eicosatrienoic Acid-d6
sc-214729	Cis-11,14-Eicosadienoic acid ethyl ester
sc-499335A	(Z, Z) -5,11-Eicosadienoic Acid-d3
sc-214730	Cis-11,14-Eicosadienoic acid methyl ester

Catalog	Name
T84629-01	8,11-Eicosadiynoic acid
MBS392170-01	5,7-Eicosadiynoic Acid
C5811-10	5,8,11-Eicosatriynoic Acid
MBS394070-01	8,11,14-Eicosatriynoic acid
274881-01	Cis-8,11,14-Eicosatrienoic acid
BML-ET004-0020	5,8,11,14-Eicosatetraynoic acid
14326-91	5,8,11,14,17-Eicosapentaenoic Acid
411392	1,4,8,11-Tetraazacyclotetradecane-1,4,8,11-tetraacetic Acid Hydrochloride
AR-P32109-01	Cis-8,11,14-Eicosatrienoic Acid-d6
MBS6039625-01	Arachidonic Acid, 99% (5,8,11,14-Eicosatetraenoic Acid)