CAS RN: 38765-83-2
BUTYRIC-1-13C ACID
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250427 |
1g |
Out of stock |
30 business days | Inquiry |
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Product code:
starshine_CAS38765-83-2
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Purity/Analytical Methods:
>99.0%
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38765-83-2 / (113C)butanoic acid
Standard CAS: 38765-83-2
Multi CAS: No
Basic Information
CAS
38765-83-2
Multi CAS
No
Molecular Formula
C4H8O2
Molecular Weight
89.100000
Exact Mass
89.055784
InChI
InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)/i4+1
InChIKey
FERIUCNNQQJTOY-AZXPZELESA-N
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
0.75
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
22.54
TPSA
37.3
LogP / Solubility
WLOGP
0.87
MLOGP
0.75
XLogP3
0.8
Consensus LogP
0.81
Log S (ESOL)
-0.8
Class (ESOL)
Very soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.2
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)
-2.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5