Undecanoic acid

CAT: 0024-sc-216039ASize: 250 gDry Ice: NoHazardous: No

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CAT#:0024-sc-216039ASize:250 g

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CAS Number

112-37-8

Chemical Information

Undecanoic Acid

Undecanoic acid is a straight-chain, eleven-carbon saturated medium-chain fatty acid found in body fluids; the most fungitoxic of the C7:0 - C18:0 fatty acid series. It has a role as an antifungal agent and a human metabolite. It is a straight-chain saturated fatty acid and a medium-chain fatty acid. It is a conjugate acid of an undecanoate. It derives from a hydride of an undecane.

CAS Number	112-37-8
PubChem CID	8180
IUPAC Name	undecanoic acid
Molecular Formula	C11H22O2
Molecular Weight	186.29
XLogP	3.7
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Heavy Atom Count	13
Formal Charge	0
Complexity	121

SMILES

CCCCCCCCCCC(=O)O

InChI

InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13)

InChIKey

ZDPHROOEEOARMN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 112-37-8

CID: 8180

Formula: C11H22O2

MW: 186.29

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	186.29
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	9
Exact Mass	186.161979940
Monoisotopic Mass	186.161979940
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	121
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

Related Products

Catalog	Name
sc-258325	Undecanoic δ-lactone
sc-224339	Undecanoic γ-lactone
sc-223142A	10-Undecynoic acid
sc-213573	10-Undecenoic acid
sc-213573A	10-Undecenoic acid
sc-288324A	2-Undecenoic Acid
sc-223142	10-Undecynoic acid
sc-288324	2-Undecenoic Acid
sc-227147	9-Undecynoic acid
sc-272635	Trans-2-Undecenoic acid

Alternative Products

Catalog	Name
HY-W004282-01	Undecanoic acid
TRC-U788851-50MG	Undecanoic-d21 Acid
GTR19305455-01	NBD-undecanoic acid
HY-W004282S1-01	Undecanoic acid-d3
HY-W004282S2-01	Undecanoic acid-d2
A17881-1000	Undecanoic acid 1g
HY-W004282R-01	Undecanoic acid (Standard)
HY-W004282S-01	Undecanoic acid-d21

Undecanoic acid

Chemical Information

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