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CAS 38923-57-8 METHYL 2,2-DIMETHYLACETOACETATE molecular structure lightbox
CAS RN: 38923-57-8

METHYL 2,2-DIMETHYLACETOACETATE

  • Product code: SSC-146531
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 38923-57-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 5 In Stock Shanghai Inquiry
5g ≥95% 2 In Stock Beijing Inquiry
10g ≥95% 1 In Stock Shanghai Inquiry
25g ≥95% 1 In Stock Shanghai Inquiry
100g ≥95% 0 Out of Stock Shanghai Inquiry

38923-57-8 / methyl 2,2-dimethyl-3-oxobutanoate

Standard CAS: 38923-57-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38923-57-8
Multi CAS
Yes
Molecular Formula
C7H12O3
Molecular Weight
144.170000
Exact Mass
144.078644
InChI
InChI=1S/C7H12O3/c1-5(8)7(2,3)6(9)10-4/h1-4H3
InChIKey
LVSDLZIEHYYLTC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.71
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
36.48
TPSA
43.37

LogP / Solubility

WLOGP
0.77
MLOGP
0.67
XLogP3
0.9
Consensus LogP
0.78
Log S (ESOL)
-1.09
Class (ESOL)
Soluble
Log S (Ali)
-1.3
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.05

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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