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CAS 119-13-1 D-DELTA-TOCOPHEROL molecular structure lightbox
CAS RN: 119-13-1

D-DELTA-TOCOPHEROL

Product Availability

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9 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250412 1g In stock Inquiry
Batchno.20250604 200mg Out of stock Inquiry
Batchno.20260127 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251128 100mg In stock Shanghai Inquiry
Batchno.20250329 10g Out of stock Inquiry
Batchno.20251204 1g In stock Shanghai Inquiry
Batchno.20250105 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20260518 50mg In stock Shanghai Inquiry
Batchno.20250422 5g In stock Shanghai Inquiry
  • Product code: SSC-019223
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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: 1g
  • Available purity: ≥98%
  • 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 119-13-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Hong Kong Inquiry

119-13-1 / (2R)-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol

delta-Tocopherol | (+)-delta-Tocopherol | 8-Methyltocol

Standard CAS: 119-13-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
119-13-1
Multi CAS
Yes
Molecular Formula
C27H46O2
Molecular Weight
402.700000
Exact Mass
402.349781
SMILES
CC1=CC(=CC2=C1O[C@](CC2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O
InChI
InChI=1S/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3/t21-,22-,27-/m1/s1
InChIKey
GZIFEOYASATJEH-VHFRWLAGSA-N
Synonyms
delta-Tocopherol (+)-delta-Tocopherol 8-Methyltocol (2R)-3,4-dihydro-2,8-dimethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-ol (R,R,R)-delta-Tocopherol

Physical Properties

Melting Point
< 25 °C
Physical Description
Clear, viscous, pale yellowish or orange oil which oxidises and darkens on exposure to air or light Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
6
Fraction Csp3
0.78
Rotatable bonds
12
H-bond acceptors
2
H-bond donors
1
Molar refractivity
124.92
TPSA
29.46

LogP / Solubility

WLOGP
8.22
MLOGP
7.26
XLogP3
10
Consensus LogP
8.49
Log S (ESOL)
-6.88
Class (ESOL)
Insoluble
Log S (Ali)
-8.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.54
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.66

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 152 of 153 companies (only 0.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

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