CAS 31080-41-8 | Octanoic acid, 2-propyl- | CAS Number 31080-41-8

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31080-41-8 | Octanoic acid, 2-propyl-

CAS No: 31080-41-8 Catalog No: AG00322Q MDL No:

Product Description

Catalog Number:

AG00322Q

Chemical Name:

Octanoic acid, 2-propyl-

CAS Number:

31080-41-8

Molecular Formula:

C11H22O2

Molecular Weight:

186.2912

IUPAC Name:

2-propyloctanoic acid

InChI:

InChI=1S/C11H22O2/c1-3-5-6-7-9-10(8-4-2)11(12)13/h10H,3-9H2,1-2H3,(H,12,13)

InChI Key:

YCYMCMYLORLIJX-UHFFFAOYSA-N

SMILES:

CCCCCCC(C(=O)O)CCC

Properties

Complexity:

132

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

186.162g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

186.295g/mol

Monoisotopic Mass:

186.162g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7

Literature

Title	Journal
Involvement of metabotropic glutamate receptor 5, AKT/PI3K signaling and NF-κB pathway in methamphetamine-mediated increase in IL-6 and IL-8 expression in astrocytes.	Journal of neuroinflammation 20120101
Treating the acute stroke patient as an emergency: current practices and future opportunities.	International journal of clinical practice 20060401
Protection of dopaminergic neurons with a novel astrocyte modulating agent (R)-(-)-2-propyloctanoic acid (ONO-2506) in an MPTP-mouse model of Parkinson's disease.	Journal of the neurological sciences 20030415
Astrocytic activation and delayed infarct expansion after permanent focal ischemia in rats. Part II: suppression of astrocytic activation by a novel agent (R)-(-)-2-propyloctanoic acid (ONO-2506) leads to mitigation of delayed infarct expansion and early improvement of neurologic deficits.	Journal of cerebral blood flow and metabolism : official journal of the International Society of Cerebral Blood Flow and Metabolism 20020601