CAS RN: 638-37-9

SUCCINALDEHYDE

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4 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260424 1g Out of stock Inquiry
Batchno.20260507 250mg In stock Inquiry
Batchno.20260504 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251120 250mg / 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
  • Product code: LINS885982
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638-37-9 / butanedial

Standard CAS: 638-37-9 Multi CAS: No

Basic Information

CAS
638-37-9
Multi CAS
No
Molecular Formula
C4H6O2
Molecular Weight
86.090000
Exact Mass
86.036779
InChI
InChI=1S/C4H6O2/c5-3-1-2-4-6/h3-4H,1-2H2
InChIKey
PCSMJKASWLYICJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
21.36
TPSA
34.14

LogP / Solubility

WLOGP
0.16
MLOGP
0.13
XLogP3
-0.9
Consensus LogP
-0.2
Log S (ESOL)
-0.28
Class (ESOL)
Very soluble
Log S (Ali)
-0.38
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.72
Class (SILICOS-IT)
Very 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)
-3.13

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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