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CAS 62563-15-9 (-)-DIBUTYL-D-TARTRATE molecular structure lightbox
CAS RN: 62563-15-9

(-)-DIBUTYL-D-TARTRATE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250521 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS62563-15-9
  • Purity/Analytical Methods: >99.0%
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62563-15-9 / dibutyl (2R,3R)-2,3-dihydroxybutanedioate

Standard CAS: 62563-15-9 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
62563-15-9
Multi CAS
Yes
Molecular Formula
C12H22O6
Molecular Weight
262.300000
Exact Mass
262.141638
InChI
InChI=1S/C12H22O6/c1-3-5-7-17-11(15)9(13)10(14)12(16)18-8-6-4-2/h9-10,13-14H,3-8H2,1-2H3/t9-,10-/m0/s1
InChIKey
PCYQQSKDZQTOQG-UWVGGRQHSA-N

Physical Properties

Physical Description
Melting point = 22 deg C; [ChemIDplus] Clear colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.83
Rotatable bonds
9
H-bond acceptors
6
H-bond donors
2
Molar refractivity
63.75
TPSA
93.06

LogP / Solubility

WLOGP
0.39
MLOGP
0.35
XLogP3
1.5
Consensus LogP
0.75
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.77
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
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)
-4.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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