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CAS 1921-70-6 2,6,10,14-Tetramethylpentadecane molecular structure lightbox
CAS RN: 1921-70-6

2,6,10,14-Tetramethylpentadecane

  • Product code: SSC-089918
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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: 1ml
  • 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 1921-70-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1ml ≥95% 0 Out of Stock Shenzhen Inquiry

1921-70-6 / 2,6,10,14-tetramethylpentadecane

Standard CAS: 1921-70-6 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1921-70-6
Multi CAS
No
Molecular Formula
C19H40
Molecular Weight
268.500000
Exact Mass
268.313001
SMILES
CC(C)CCCC(C)CCCC(C)CCCC(C)C
InChI
InChI=1S/C19H40/c1-16(2)10-7-12-18(5)14-9-15-19(6)13-8-11-17(3)4/h16-19H,7-15H2,1-6H3
InChIKey
XOJVVFBFDXDTEG-UHFFFAOYSA-N

Physical Properties

Melting Point
-60 °C /freezing point/ -100 °C
Boiling Point
296 °C 296.00 °C. @ 760.00 mm Hg
Density
0.775-0.795 at 20 °C
Physical Description
Transparent liquid; [Merck Index] Colorless liquid; Liquid
Appearance
Colorless, transparent; stable liquid Mobile, transparent, stable liquid
State
Liquid
Storage Conditions
Conditions for safe storage, including any incompatibilities: Keep container tightly closed in a dry and well-ventilated place. Containers which are opened must be carefully resealed and kept upright to prevent leakage.

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
1
Rotatable bonds
12
Molar refractivity
89.56
TPSA
0.0000

LogP / Solubility

WLOGP
7.08
MLOGP
6.24
XLogP3
9.3
Consensus LogP
7.54
Log S (ESOL)
-5.17
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.87
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.72
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
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)
0.67

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (97.8%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (95.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H315: Causes skin irritation [Warning Skin corrosion/irritation] H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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