CAS RN: 1567-75-5
Methyl 1-methylcyclopropyl ketone
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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: 5g, 10g, 1g, 25g, 100g
- Available purity: >98%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 1567-75-5
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 5g |
>98% |
5
In Stock
|
Beijing |
Inquiry |
| 10g |
>98% |
5
In Stock
|
Beijing |
Inquiry |
| 1g |
>98% |
3
In Stock
|
Hong Kong |
Inquiry |
| 25g |
>98% |
2
In Stock
|
Shenzhen |
Inquiry |
| 100g |
>98% |
2
In Stock
|
Hong Kong |
Inquiry |
1567-75-5 / 1-(1-methylcyclopropyl)ethanone
Standard CAS: 1567-75-5
Multi CAS: No
Basic Information
CAS
1567-75-5
Multi CAS
No
Molecular Formula
C6H10O
Molecular Weight
98.140000
Exact Mass
98.073165
SMILES
CC(=O)C1(CC1)C
InChI
InChI=1S/C6H10O/c1-5(7)6(2)3-4-6/h3-4H2,1-2H3
InChIKey
OQBCJXUAQQMTRW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
0.83
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
28.02
TPSA
17.07
LogP / Solubility
WLOGP
1.38
MLOGP
1.2
XLogP3
0.8
Consensus LogP
1.13
Log S (ESOL)
-1.25
Class (ESOL)
Soluble
Log S (Ali)
-1.36
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.56
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)
-2.34
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Flammable
Signal
Warning
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501