CAS RN: 1414375-00-0
(2E)-TCO-OH
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251013 | 100mg | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20251216 | 1g | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250529 | 250mg | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry |
| Batchno.20250726 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250601 | 50mg / 100mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS1414375-00-0
- Purity/Analytical Methods: >99.0%
1414375-00-0 / (2Z)-cyclooct-2-en-1-ol
Basic Information
CAS
1414375-00-0
Multi CAS
No
Molecular Formula
C8H14O
Molecular Weight
126.200000
Exact Mass
126.104465
SMILES
C1CC/C=C\C(CC1)O
InChI
InChI=1S/C8H14O/c9-8-6-4-2-1-3-5-7-8/h4,6,8-9H,1-3,5,7H2/b6-4-
InChIKey
UJZBDMYKNUWDPM-XQRVVYSFSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.75
H-bond acceptors
1
H-bond donors
1
Molar refractivity
38.23
TPSA
20.23
LogP / Solubility
WLOGP
1.87
MLOGP
1.63
XLogP3
2.1
Consensus LogP
1.87
Log S (ESOL)
-1.8
Class (ESOL)
Soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.03
Class (SILICOS-IT)
Moderately 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)
-2.16
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
2
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H227 (100%): Combustible liquid [Warning Flammable liquids]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501
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