200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 96017-59-3
96017-59-3 | 2-Hexyl-4-pentynoic Acid , 93%
CAS No: 96017-59-3 Catalog No: AG003HD5 MDL No:MFCD00946863
Product Description
Catalog Number:
AG003HD5
Chemical Name:
2-Hexyl-4-pentynoic Acid , 93%
CAS Number:
96017-59-3
Molecular Formula:
C11H18O2
Molecular Weight:
182.2594
MDL Number:
MFCD00946863
IUPAC Name:
2-prop-2-ynyloctanoic acid
InChI:
InChI=1S/C11H18O2/c1-3-5-6-7-9-10(8-4-2)11(12)13/h2,10H,3,5-9H2,1H3,(H,12,13)
InChI Key:
DUQSBRQHALCSLC-UHFFFAOYSA-N
SMILES:
CCCCCCC(C(=O)O)CC#C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.263g/mol
Monoisotopic Mass:
182.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Potent neuroprotective effects of novel structural derivatives of valproic acid: potential roles of HDAC inhibition and HSP70 induction. | Neuroscience letters 20100607 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.