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CAS 1098183-73-3 1-(Trifluoromethyl)cyclobutan-1-ol molecular structure lightbox
CAS RN: 1098183-73-3

1-(Trifluoromethyl)cyclobutan-1-ol

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250607 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: SSC-011136
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1098183-73-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1098183-73-3 / 1-(trifluoromethyl)cyclobutan-1-ol

1-(trifluoromethyl)cyclobutan-1-ol | 1-(Trifluoromethyl)cyclobutanol | DTXSID201303873

Standard CAS: 1098183-73-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1098183-73-3
Multi CAS
No
Molecular Formula
C5H7F3O
Molecular Weight
140.100000
Exact Mass
140.044899
SMILES
C1CC(C1)(C(F)(F)F)O
InChI
InChI=1S/C5H7F3O/c6-5(7,8)4(9)2-1-3-4/h9H,1-3H2
InChIKey
LAVGIFVKTRAAKV-UHFFFAOYSA-N
Synonyms
1-(trifluoromethyl)cyclobutan-1-ol 1-(Trifluoromethyl)cyclobutanol DTXSID201303873 RefChem:428825 DTXCID801733901

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
24.86
TPSA
20.23

LogP / Solubility

WLOGP
1.46
MLOGP
1.28
XLogP3
1.4
Consensus LogP
1.38
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-1.77
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
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)
-2.54

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 Irritant
Signal
Warning
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [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, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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