CAS RN: 123-35-3
Myrcene (stabilized with BHT)
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251229 | 100ml / 500ml / 2.5L | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: SSC-026691
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: 500g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 500g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
123-35-3 / 7-methyl-3-methylideneocta-1,6-diene
Basic Information
CAS
123-35-3
Multi CAS
No
Molecular Formula
C10H16
Molecular Weight
136.230000
Exact Mass
136.125201
SMILES
CC(=CCCC(=C)C=C)C
InChI
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
InChIKey
UAHWPYUMFXYFJY-UHFFFAOYSA-N
Physical Properties
Melting Point
< -10 °C
Boiling Point
332.6 °F at 760 mmHg (USCG, 1999)
167 °C
166.00 to 167.00 °C. @ 760.00 mm Hg
Density
0.794 at 20 °C/4 °C
Density: 0.7959 at 25 °C/25 °C; max absorption (isooctane): 224.5 nm /alpha-Myrcene/
0.789-0.793
Physical Description
Myrcene, [liquid] appears as a yellow oily liquid with a pleasant odor. Flash point below 200 °F. Insoluble in water and less dense than water.
Liquid
Yellow liquid with a pleasant odor; [Hawley]
Colourless or very pale straw-coloured mobile liquid; sweet balsamic aroma
Appearance
Yellow, oily liquid
State
Liquid
Storage Conditions
Store in a cool place from which light and air are excluded.
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.4
Rotatable bonds
4
Molar refractivity
48
TPSA
0.0000
LogP / Solubility
WLOGP
3.48
MLOGP
3.05
XLogP3
4.3
Consensus LogP
3.61
Log S (ESOL)
-2.61
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.91
Class (SILICOS-IT)
Poorly 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)
-1.08
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
1.5
Safety & Transport
Pictogram(s)
Flammable
Irritant
Health Hazard
Environmental Hazard
Signal
Danger
Warning
GHS Hazard Statements
H226 (99.8%): Flammable liquid and vapor [Warning Flammable liquids]
H304 (99%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]
H315 (85.6%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (85.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H400 (14.6%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P264, P264+P265, P273, P280, P301+P316, P302+P352, P303+P361+P353, P305+P351+P338, P321, P331, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P235, P405, and P501
P203, P210, P233, P240, P241, P242, P243, P264, P264+P265, P273, P280, P302+P352, P303+P361+P353, P305+P351+P338, P318, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P235, P405, and P501
P203, P210, P233, P240, P241, P242, P243, P264, P280, P302+P352, P303+P361+P353, P318, P321, P332+P317, P362+P364, P370+P378, P403+P235, P405, and P501
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