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CAS 544-76-3 Reference Material for Flash Point Certified by The Japan Petroleum Institute, Hexadecane molecular structure lightbox
CAS RN: 544-76-3

Reference Material for Flash Point Certified by The Japan Petroleum Institute, Hexadecane

Product Availability

Choose a grade to view its available package options.

8 package records7 with current stock6 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260123 2ml In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260202 1.2ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251229 100ml In stock Shanghai, Shandong, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250227 25ml / 100ml / 500ml / 2.5L / 10L / 12X500ml Confirm by inquiry Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250413 100ml Out of stock Inquiry
Batchno.20251120 25ml In stock Inquiry
Batchno.20260503 5ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250521 5ml In stock Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
  • Product code: SSC-162069
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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: 500g
  • 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 544-76-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ＞97% 0 Out of Stock Hong Kong Inquiry

544-76-3 / hexadecane

Standard CAS: 544-76-3 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
544-76-3
Multi CAS
No
Molecular Formula
C16H34
Molecular Weight
226.440000
Exact Mass
226.266051
InChI
InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
InChIKey
DCAYPVUWAIABOU-UHFFFAOYSA-N

Physical Properties

Melting Point
64.7 °F (NTP, 1992) 18.18 °C 18.17 °C
Boiling Point
549 °F at 760 mmHg (NTP, 1992) boiling point equals 549 °F 286.9 °C 286.00 to 287.00 °C. @ 760.00 mm Hg
Density
0.77331 at 68 °F (NTP, 1992) - Less dense than water; will float 0.7701 g/cu cm at 25 °C
Physical Description
N-hexadecane is a colorless liquid. (NTP, 1992) Liquid Clear liquid; Melting point equals 18 degrees C; [HSDB]
Appearance
Colorless liquid Leaflets from acetone
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
1
Rotatable bonds
13
Molar refractivity
75.99
TPSA
0.0000

LogP / Solubility

WLOGP
6.49
MLOGP
5.71
XLogP3
8.3
Consensus LogP
6.83
Log S (ESOL)
-4.47
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.1
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.08
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)
0.5

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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