CAS RN: 34880-43-8
2-PROPYL-2-HEPTENAL
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250518 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS34880-43-8
- Purity/Analytical Methods: >99.0%
34880-43-8 / 2-propylhept-2-enal
Basic Information
CAS
34880-43-8
Multi CAS
Yes
Molecular Formula
C10H18O
Molecular Weight
154.250000
Exact Mass
154.135765
InChI
InChI=1S/C10H18O/c1-3-5-6-8-10(9-11)7-4-2/h8-9H,3-7H2,1-2H3/b10-8-
InChIKey
GADNZGQWPNTMCH-NTMALXAHSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.7
Rotatable bonds
6
H-bond acceptors
1
Molar refractivity
48.58
TPSA
17.07
LogP / Solubility
WLOGP
3.1
MLOGP
2.72
XLogP3
3.4
Consensus LogP
3.07
Log S (ESOL)
-2.35
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.06
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.96
Class (SILICOS-IT)
Poorly 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)
-1.46
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
Customers Also Viewed
-
-
-
2,4′-DICHLOROBIPHENYL
- CAS RN: 34883-43-7
- Product Code: starshine_CAS34883-43-7
- Purity/Analytical method: >99.0%
-
-
-
