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CAS 106-87-6 Vinylcyclohexene dioxide, 96%, mixture of isomers molecular structure lightbox
CAS RN: 106-87-6

Vinylcyclohexene dioxide, 96%, mixture of isomers

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250223 10g In stock Shanghai, Wuhan, Chengdu Inquiry
Batchno.20260412 1g In stock Shanghai, Chengdu Inquiry
Batchno.20250423 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20260603 25g In stock Shanghai Inquiry
Batchno.20250810 5g In stock Shanghai Inquiry
  • Product code: SSC-007662
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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: 10g
  • Available purity: ≥97%
  • 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 106-87-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry

106-87-6 / 3-(oxiran-2-yl)-7-oxabicyclo[4.1.0]heptane

4-Vinylcyclohexene dioxide | 4-Vinyl-1-cyclohexene dioxide | 3-(oxiran-2-yl)-7-oxabicyclo[4.1.0]heptane

Standard CAS: 106-87-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
106-87-6
Multi CAS
Yes
Molecular Formula
C8H12O2
Molecular Weight
140.180000
Exact Mass
140.083730
SMILES
C1CC2C(O2)CC1C3CO3
InChI
InChI=1S/C8H12O2/c1-2-6-7(10-6)3-5(1)8-4-9-8/h5-8H,1-4H2
InChIKey
OECTYKWYRCHAKR-UHFFFAOYSA-N
Synonyms
4-Vinylcyclohexene dioxide 4-Vinyl-1-cyclohexene dioxide 3-(oxiran-2-yl)-7-oxabicyclo[4.1.0]heptane 4-Vinylcyclohexene diepoxide VINYLCYCLOHEXENE DIOXIDE

Physical Properties

Melting Point
less than -67 °F (NTP, 1992) LESS THAN -55 °C -164 °F
Boiling Point
441 °F at 760 mmHg (NTP, 1992) 227 °C @ 760 MM HG 227 °C 441 °F
Density
1.0986 at 68 °F (NTP, 1992) - Denser than water; will sink 1.0986 @ 20 °C/20 °C Relative density (water = 1): 1.10 1.099 1.10
Physical Description
1-vinyl-3-cyclohexene dioxide is a clear colorless liquid. Sets to glass at -67 °F. Faint olefinic odor. (NTP, 1992) Colorless liquid; [NIOSH] COLOURLESS LIQUID. Colorless liquid.
Appearance
COLORLESS LIQUID Colorless liquid.
State
Liquid
Storage Conditions
STORAGE PRECAUTIONS: You should store this chemical under refrigerated temperatures, and protect it from moisture. (NTP, 1992)

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
35.74
TPSA
25.06

LogP / Solubility

WLOGP
0.95
MLOGP
0.83
XLogP3
0.8
Consensus LogP
0.86
Log S (ESOL)
-1.24
Class (ESOL)
Soluble
Log S (Ali)
-1.4
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
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)
-2.9

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
3.5

Safety & Transport

Pictogram(s)
Acute Toxic Health Hazard Irritant
Signal
Danger
GHS Hazard Statements
H302: Harmful if swallowed [Warning Acute toxicity, oral] H331: Toxic if inhaled [Danger Acute toxicity, inhalation] H341: Suspected of causing genetic defects [Warning Germ cell mutagenicity] H350: May cause cancer [Danger Carcinogenicity] H360F: May damage fertility [Danger Reproductive toxicity]
Precautionary Statement Codes
P203, P261, P264, P270, P271, P280, P301+P317, P304+P340, P316, P318, P321, P330, P403+P233, P405, and P501 P203, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P318, P321, P330, P361+P364, P403+P233, P405, and P501 P203, P260, P261, P271, P273, P280, P304+P340, P317, P318, P319, P405, and P501 P203, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P318, P319, P321, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501
Hazard Class/Division
6.1

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