Rac 5-Hydroxy valproic acid sodium

CAT: 0926-FH162637-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-FH162637-01Size:10 mg

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CAS Number

78644-53-8

Smiles

CCCC (CCCO) C (=O) [O-].[Na+]

Molecular Formula

C8H16O3•Na

Molecular Weight

183.2 g/mol

Controlled

Chemical Information

5-Hydroxy-2-propylpentanoic acid sodium hydride

CAS Number	78644-53-8
PubChem CID	46781923
IUPAC Name	sodium 5-hydroxy-2-propylpentanoate
Molecular Formula	C8H15NaO3
Molecular Weight	182.19
Topological Polar Surface Area	60.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	12
Formal Charge	0
Complexity	117

SMILES

CCCC(CCCO)C(=O)[O-].[Na+]

InChI

InChI=1S/C8H16O3.Na/c1-2-4-7(8(10)11)5-3-6-9;/h7,9H,2-6H2,1H3,(H,10,11);/q;+1/p-1

InChIKey

CSZWWXWOLIYBAB-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 78644-53-8

CID: 46781923

Formula: C8H15NaO3

MW: 182.19

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	182.19
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	182.09188862
Monoisotopic Mass	182.09188862
Topological Polar Surface Area	60.4 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	117
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
FV30281-01	Valproic acid
FR27468	Rac 5-hydroxy propentofylline
FV28660	Valproic acid semisodium
10-V12A	Valproic Acid antibody
MLA11143-01	Rac 3-Hydroxybutyric acid-13C4 sodium
LBA60997	α-Hydroxy-cyclohexanemethanesulfonic acid sodium salt
FL24953-01	Lovastatin hydroxy acid, sodium salt
AAA09967-01	Valproic acid related compound A
FR27460-01	Rac 4-Hydroxy-9-cis-retinoic acid
FH24077-01	5-Hydroxy omeprazole sodium salt

Catalog	Name
AR-V06299-01	5-Hydroxy Valproic Acid Sodium Salt
014627-01	Rac 5-Hydroxy Valproic Acid Sodium Salt
MBS6026889-01	rac 5-Hydroxy Valproic Acid-d7 Sodium Salt
RM-V011228-01	4-Hydroxy Valproic Acid Sodium Salt
TRC-H993010-5MG	rac 5-Hydroxy Valproic Acid Sodium Salt, 90%
HY-10585A-01	Valproic acid (sodium)
ENZ-CHM367-0005	Valproic acid . sodium
S1168-01	Valproic Acid sodium
sc-209599	3-Hydroxy Valproic Acid
279583-01	Rac 5-Hydroxy valproic acid sodium salt discontinued. See 014627