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CAS 1184-88-9 sodium pivalate molecular structure lightbox
CAS RN: 1184-88-9

sodium pivalate

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250304 100g In stock Shanghai, Chengdu Inquiry
Batchno.20260328 10g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260327 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251211 25g In stock Shanghai, Shenzhen Inquiry
Batchno.20250601 500g In stock Shanghai Inquiry
Batchno.20250301 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251202 250mg / 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Chongqing Inquiry
  • Product code: SSC-018164
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 100g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1184-88-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Shenzhen Inquiry

1184-88-9 / sodium 2,2-dimethylpropanoate

Pivalic acid, sodium salt | RefChem:887815 | Sodium pivalate

Standard CAS: 1184-88-9 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1184-88-9
Multi CAS
Yes
Molecular Formula
C5H9NaO2
Molecular Weight
124.110000
Exact Mass
124.050024
SMILES
CC(C)(C)C(=O)[O-].[Na+]
InChI
InChI=1S/C5H10O2.Na/c1-5(2,3)4(6)7;/h1-3H3,(H,6,7);/q;+1/p-1
InChIKey
SJRDNQOIQZOVQD-UHFFFAOYSA-M
Synonyms
Pivalic acid, sodium salt RefChem:887815 Sodium pivalate Sodium trimethylacetate Propanoic acid, 2,2-dimethyl-, sodium salt

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
24.46
TPSA
40.13

LogP / Solubility

WLOGP
-3.21
MLOGP
-2.84
XLogP3
-3.21
Consensus LogP
-3.09
Log S (ESOL)
1.42
Class (ESOL)
Highly soluble
Log S (Ali)
1.74
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.2
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.76

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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