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Home Other Building Blocks 2-N-Hexyl-4-pentynoic acid

2-N-Hexyl-4-pentynoic acid

CAS No.:
96017-59-3
Catalog Number:
AG003HD5
Molecular Formula:
C11H18O2
Molecular Weight:
182.2594
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥95%
1 week
United States
$103
- +
500mg
≥95%
1 week
United States
$139
- +
1g
≥95%
1 week
United States
$176
- +
5g
≥95%
1 week
United States
$286
- +
25g
>95.0%(T)
1 week
United States
$1025
- +
Product Description
Catalog Number:
AG003HD5
Chemical Name:
2-N-Hexyl-4-pentynoic acid
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
Properties