Sodium Trimethylacetate Hydrate

CAT: 0572-TRC-S655043-10GSize: 10 gDry Ice: NoHazardous: No

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CAT#:0572-TRC-S655043-10GSize:10 g

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CAS Number

143174-36-1

Hazard Statement

No Data Available

Smiles

O.[Na+].CC(C)(C)C(=O)[O-]

Molecular Formula

C5H11NaO3

Molecular Weight

142.13

Shipping Conditions

Room Temperature

Chemical Information

Sodium 2,2-dimethylpropanoate--water (1/1/1)

CAS Number	143174-36-1
PubChem CID	23666172
IUPAC Name	sodium;2,2-dimethylpropanoate;hydrate
Molecular Formula	C5H11NaO3
Molecular Weight	142.13
Topological Polar Surface Area	41.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	82

SMILES

CC(C)(C)C(=O)[O-].O.[Na+]

InChI

InChI=1S/C5H10O2.Na.H2O/c1-5(2,3)4(6)7;;/h1-3H3,(H,6,7);;1H2/q;+1;/p-1

InChIKey

OXKVPNMBQUHJHF-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 143174-36-1

CID: 23666172

Formula: C5H11NaO3

MW: 142.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.13
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	142.06058849
Monoisotopic Mass	142.06058849
Topological Polar Surface Area	41.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	82.9
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	3
Compound Is Canonicalized	Yes

Catalog	Name
TRC-P993515-500MG	Potassium Trimethylacetate
TRC-P993515-1G	Potassium Trimethylacetate
TRC-P993515-5G	Potassium Trimethylacetate
TRC-M520550-5MG	Moniliformin Sodium Hydrate
TRC-S667500-5G	Sodium Metatungstate Hydrate
TRC-A576500-100MG	Amfenac Sodium Hydrate
TRC-S667500-25G	Sodium Metatungstate Hydrate
F728900	Fosphenytoin Sodium Hydrate
TRC-S634910-1MG	Sodium Thiophosphate Hydrate
TRC-S634820-10G	Sodium Hydrosulfide Hydrate

Catalog	Name
abx186560-01	Sodium Trimethylacetate Hydrate
TN9430-01	Sodium Trimethylacetate xHydrate
MBS3841426-01	Sivelestat sodium hydrate (ONO-5046 sodium hydrate)
A16137-25	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 25mg
A16137-5	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 5mg
A16137-200	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 200mg
A16137-100	Sivelestat sodium hydrate (ONO-5046 sodium hydrate) 100mg
B8786-50	Bromfenac sodium hydrate
525606	Meclofenamate sodium hydrate
563557	Sivelestat Sodium hydrate