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CAS 112-84-5 Erucamide molecular structure lightbox
CAS RN: 112-84-5

Erucamide

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251106 100g In stock Shanghai, Shandong, Guangdong, Chongqing, Hebei Inquiry
Batchno.20250203 2.5kg In stock Shandong Inquiry
Batchno.20251007 500g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
  • Product code: SSC-012512
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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: tech. 85%
  • 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 112-84-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g tech. 85% 0 Out of Stock Hong Kong Inquiry

112-84-5 / (Z)-docos-13-enamide

13-Docosenamide | DTXSID20274488 | CHEBI:156290

Standard CAS: 112-84-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
112-84-5
Multi CAS
Yes
Molecular Formula
C22H43NO
Molecular Weight
337.600000
Exact Mass
337.334465
SMILES
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)N
InChI
InChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h9-10H,2-8,11-21H2,1H3,(H2,23,24)/b10-9-
InChIKey
UAUDZVJPLUQNMU-KTKRTIGZSA-N
Synonyms
13-Docosenamide DTXSID20274488 CHEBI:156290 RefChem:1057467 DTXCID90225967

Physical Properties

Melting Point
75-80 °C
Physical Description
Dry Powder, Pellets or Large Crystals; Pellets or Large Crystals; Dry Powder; Other Solid Solid; [Hawley] Off-white beads with a fatty odor
Appearance
SOLID
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
24
Fraction Csp3
0.86
Rotatable bonds
19
H-bond acceptors
1
H-bond donors
1
Molar refractivity
107.11
TPSA
43.09

LogP / Solubility

WLOGP
7.07
MLOGP
6.24
XLogP3
8.8
Consensus LogP
7.37
Log S (ESOL)
-5.13
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.43
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.24

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
2.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (32.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (32.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (32.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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