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33786-47-9,MFCD00801107
Catalog No.:AA003HRC
33786-47-9 | (E)-2-Propylpent-2-enoic acid
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Purity
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25mg
95%
2 weeks  
$185.00   $130.00
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100mg
95%
2 weeks  
$469.00   $328.00
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250mg
95%
2 weeks  
$1,035.00   $725.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003HRC
Chemical Name:
(E)-2-Propylpent-2-enoic acid
CAS Number:
33786-47-9
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
MDL Number:
MFCD00801107
IUPAC Name:
2-propylpent-2-enoic acid
InChI:
InChI=1S/C8H14O2/c1-3-5-7(6-4-2)8(9)10/h5H,3-4,6H2,1-2H3,(H,9,10)
InChI Key:
ZKNJEOBYOLUGKJ-UHFFFAOYSA-N
SMILES:
CCC/C(=C\CC)/C(=O)O
Properties
Computed Properties
 
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.4  

Synonyms
 
(E)-2-ene valproic acid 
2-envalproic acid 
E-delta(2)-valproic acid 
trans-2-en-valproate 
trans-2-en-VPA 
trans-2-ene-valproic acid 
2-propylpent-2-enoic acid 
33786-47-9 
2-Pentenoic acid, 2-propyl- 
60218-41-9 
2-Pentenoic acid, 2-propyl-, (2E)- 
33786-46-8 
2-enVPA 
(E,Z) 2-Propyl-2-pentenoic Acid 
2-Pentenoicacid,2-propyl-,(2E)- 
SCHEMBL691600 
2-n-propylpenta-2-enoic acid 
CTK2F1127 
CTK5D1408 
ZKNJEOBYOLUGKJ-UHFFFAOYSA-N 
KS-000000VS 
AKOS026730287 
FT-0613382 
2-n-propylpent-2-enoic acid 
69827-64-1 
2-Pentenoic acid,2-propyl-, sodium salt (1:1) 
trans-2-en-Vpa 
delta2,3 Vpe 
2-En-valproic acid 
delta2-Valproic acid 
trans-2-en-Valproate 
2-Propyl-2-pentenoic acid 
delta-2(E)-Valproate 
E-2-en-Valproic acid 
2-propyl-2-pentenoic acid 
trans-2-Ene-valproic acid 
(E)-2-Ene-valproic acid 
E-delta(2)-Valproic acid 
(E)-2-en-VPA 
(E)-2-propylpent-2-enoic acid 
2-n-Propylpent-2-enoic acid 
UNII-6W67L10M6T 
trans-2-Propyl-2-pentenoic acid 
(2E)-2-Propyl-2-pentenoic acid 
(E,Z)-2-Propyl-2-pentenoic Acid 
2-propyl-2-pentenoic acid, (E)-isomer 
C8-H14-O2 
2-Propyl-2-pentenoic acid, (2E)- 
Valeric acid, 2-propylidene-, (E)- 
2-Pentenoic acid, 2-propyl-, (E)- 
2-N-PROPYL-2(E)-PENTENOICACID 
2-propyl-2-pentenoic acid, (Z)-isomer 
2-propyl-2-pentenoic acid, sodium salt 
delta2,3 VPE 
delta2-valproic acid 
Literature

Title: Pyruvate uptake is inhibited by valproic acid and metabolites in mitochondrial membranes.

Journal: FEBS letters 20081015

Title: Histone deacetylases inhibition and tumor cells cytotoxicity by CNS-active VPA constitutional isomers and derivatives.

Journal: Biochemical pharmacology 20050515

Title: Science review: carnitine in the treatment of valproic acid-induced toxicity - what is the evidence?

Journal: Critical care (London, England) 20050101

Title: Differential effect of valproate and its Delta2- and Delta4-unsaturated metabolites, on the beta-oxidation rate of long-chain and medium-chain fatty acids.

Journal: Chemico-biological interactions 20010928

Title: Comparative evaluation of anticonvulsant and toxic potencies of valproic acid and 2-en-valproic acid in different animal models of epilepsy.

Journal: European journal of pharmacology 19840323

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