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CAS 1800-91-5 1,6-DIVINYLPERFLUOROHEXANE molecular structure lightbox
CAS RN: 1800-91-5

1,6-DIVINYLPERFLUOROHEXANE

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260213 100g In stock Shanghai Inquiry
Batchno.20251017 10g In stock Shanghai Inquiry
Batchno.20260508 1g In stock Shanghai Inquiry
Batchno.20251206 25g In stock Shanghai Inquiry
Batchno.20250212 5g In stock Shanghai Inquiry
  • Product code: SSC-080401
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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: 5g
  • 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 1800-91-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

1800-91-5 / 3,3,4,4,5,5,6,6,7,7,8,8-dodecafluorodeca-1,9-diene

Standard CAS: 1800-91-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1800-91-5
Multi CAS
No
Molecular Formula
C10H6F12
Molecular Weight
354.130000
Exact Mass
354.027788
SMILES
C=CC(C(C(C(C(C(C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H6F12/c1-3-5(11,12)7(15,16)9(19,20)10(21,22)8(17,18)6(13,14)4-2/h3-4H,1-2H2
InChIKey
PDFSXHZXNZCKNF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Fraction Csp3
0.6
Rotatable bonds
7
H-bond acceptors
12
Molar refractivity
50.08
TPSA
0.0000

LogP / Solubility

WLOGP
5.17
MLOGP
4.57
XLogP3
5.5
Consensus LogP
5.08
Log S (ESOL)
-4.83
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.2
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.09
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.21

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Flammable Irritant Health Hazard
Signal
Warning
GHS Hazard Statements
H226 (14.3%): Flammable liquid and vapor [Warning Flammable liquids] H315 (28.6%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (28.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (14.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H373 (14.3%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P273, 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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