Potassium 4-Hydroxy-4-methylpentanoate

CAT: 0572-TRC-P993770-10MGSize: 10 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-P993770-10MGSize:10 mg

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CAS Number

1607261-66-4

Hazard Statement

Causes skin irritation

Smiles

[K+].CC(C)(O)CCC(=O)[O-]

Molecular Weight

170.24

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

Potassium 4-hydroxy-4-methylpentanoate

CAS Number	1607261-66-4
PubChem CID	75421081
IUPAC Name	potassium 4-hydroxy-4-methylpentanoate
Molecular Formula	C6H11KO3
Molecular Weight	170.25
Topological Polar Surface Area	60.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	10
Formal Charge	0
Complexity	112

SMILES

CC(C)(CCC(=O)[O-])O.[K+]

InChI

InChI=1S/C6H12O3.K/c1-6(2,9)4-3-5(7)8;/h9H,3-4H2,1-2H3,(H,7,8);/q;+1/p-1

InChIKey

SPIZJFCPJRORDE-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 1607261-66-4

CID: 75421081

Formula: C6H11KO3

MW: 170.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.25
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	170.03452569
Monoisotopic Mass	170.03452569
Topological Polar Surface Area	60.4 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	112
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
TRC-B587600-10MG	methyl 2-hydroxy-4-methylpentanoate
TRC-B587600-100MG	methyl 2-hydroxy-4-methylpentanoate
TRC-M312765-5G	Methyl 3-Hydroxy-4-methylpentanoate
TRC-B587600-50MG	methyl 2-hydroxy-4-methylpentanoate
TRC-P994268-50MG	Potassium 2-hydroxy-4-methoxybenzoate
TRC-P994268-500MG	Potassium 2-hydroxy-4-methoxybenzoate
TRC-P994268-100MG	Potassium 2-hydroxy-4-methoxybenzoate
TRC-H971075-250MG	4-Hydroxy Triamterene Sulfate Potassium Salt
TRC-M483800-1G	Methyl 5-Chloro-4-Methylpentanoate
TRC-E902410-500MG	Ethyl 5-Chloro-4-Methylpentanoate

Catalog	Name
HPC26166-01	Potassium 4-hydroxy-4-methylpentanoate
CS-O-06040	4-Hydroxy propranolol sulfate Potassium
sc-264126	Potassium 4-hydroxy-3-methylphenyltrifluoroborate
OR80288-01	Potassium 2-hydroxy-4-methoxybenzoate
HQB18979-01	Potassium 4- (4-hydroxy-3-nitrobenzenesulfonamido) benzoate
sc-264128	Potassium 4'-hydroxy-[1,1'-biphenyl]-4-trifluoroborate
HY-W097858-01	2-Hydroxy-4-methoxybenzoic acid (potassium)
TN8323-01	2-Hydroxy-4-methoxybenzoic acid potassium
sc-212573	Potassium 1-Hydroxy-4-naphthol Sulfate
432583-01	4-Hydroxy Triamterene Sulfate Potassium Salt