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CAS 1139-30-6 CARYOPHYLLENE OXIDE molecular structure lightbox
CAS RN: 1139-30-6

CARYOPHYLLENE OXIDE

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17 package records14 with current stock6 grade groups
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Batchno.20251106 100g In stock Inquiry
Batchno.20250628 1g In stock Inquiry
Batchno.20250825 25g In stock Inquiry
Batchno.20250118 5g In stock Inquiry
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Batchno.20260111 1g In stock Shanghai, Shandong Inquiry
Batchno.20250322 25g Out of stock 5-7 business days Inquiry
Batchno.20260412 5g In stock Shanghai Inquiry
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Batchno.20251016 1ml Out of stock 5-7 business days Inquiry
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Batchno.20250605 1ml In stock Shandong Inquiry
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Batchno.20251025 1ml Out of stock 5-7 business days Inquiry
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Batchno.20250902 100g In stock Shanghai Inquiry
Batchno.20250407 10g In stock Shanghai Inquiry
Batchno.20260511 1g In stock Shanghai, Tianjin Inquiry
Batchno.20251007 1g / 5g / 10g / 50g / 250g Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei 5-7 business days Inquiry
Batchno.20250331 250mg In stock Shanghai Inquiry
Batchno.20260512 25g In stock Shanghai Inquiry
Batchno.20260425 5g In stock Shanghai Inquiry
  • Product code: SSC-013875
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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: 0.25g
  • 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 1139-30-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry

1139-30-6 / (1R,4R,6R,10S)-4,12,12-trimethyl-9-methylidene-5-oxatricyclo[8.2.0.04,6]dodecane

4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane | 5-Oxatricyclo[8.2.0.04,6]dodecane, 4,12,12-trimethyl-9-methylene- | DTXSID50859585

Standard CAS: 1139-30-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1139-30-6
Multi CAS
Yes
Molecular Formula
C15H24O
Molecular Weight
220.350000
Exact Mass
220.182715
SMILES
C[C@@]12CC[C@@H]3[C@H](CC3(C)C)C(=C)CC[C@H]1O2
InChI
InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1
InChIKey
NVEQFIOZRFFVFW-RGCMKSIDSA-N
Synonyms
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane 5-Oxatricyclo[8.2.0.04,6]dodecane, 4,12,12-trimethyl-9-methylene- DTXSID50859585 5-Oxatricyclo(8.2.0.04,6)dodecane, 4,12,12-trimethyl-9-methylene- 4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane

Physical Properties

Physical Description
Fine colorless crystals; Colourless solid; Sweet fruity aroma
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.87
H-bond acceptors
1
Molar refractivity
66.26
TPSA
12.53

LogP / Solubility

WLOGP
3.94
MLOGP
3.47
XLogP3
3.6
Consensus LogP
3.67
Log S (ESOL)
-3.69
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.21
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.36
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.27

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
5

Safety & Transport

Pictogram(s)
Irritant Environmental Hazard
Signal
Warning
GHS Hazard Statements
H315 (45.9%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (45.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H411 (68.8%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501

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