Trans-Nervonic acid

CAT: 0024-sc-507107Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-507107Size:5 mg

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CAS Number

115863-91-7

Chemical Information

15-Tetracosenoic acid

Trans-selacholeic acid is a very long-chain fatty acid.

CAS Number	115863-91-7
PubChem CID	5282773
IUPAC Name	(E)-tetracos-15-enoic acid
Molecular Formula	C24H46O2
Molecular Weight	366.6
XLogP	9.8
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	21
Heavy Atom Count	26
Formal Charge	0
Complexity	309

SMILES

CCCCCCCC/C=C/CCCCCCCCCCCCCC(=O)O

InChI

InChI=1S/C24H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h9-10H,2-8,11-23H2,1H3,(H,25,26)/b10-9+

InChIKey

GWHCXVQVJPWHRF-MDZDMXLPSA-N

Chemical Structure

2D Structure

CAS: 115863-91-7

CID: 5282773

Formula: C24H46O2

MW: 366.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	366.6
XLogP3	9.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	21
Exact Mass	366.349780706
Monoisotopic Mass	366.349780706
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	309
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes