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CAS 536-46-9 N,N-Dimethyl-1,4-phenylenediamine Dihydrochloride [for Biochemical Research] molecular structure lightbox
CAS RN: 536-46-9

N,N-Dimethyl-1,4-phenylenediamine Dihydrochloride [for Biochemical Research]

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251130 100g In stock Inquiry
Batchno.20250615 1g In stock Inquiry
Batchno.20251225 25g In stock Inquiry
Batchno.20250129 500g In stock Inquiry
Batchno.20260404 5g In stock Inquiry
  • Product code: SSC-160973
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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: 25g
  • 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 536-46-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Shenzhen Inquiry

536-46-9 / 4-N,4-N-dimethylbenzene-1,4-diamine;dihydrochloride

Standard CAS: 536-46-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
536-46-9
Multi CAS
Yes
Molecular Formula
C8H14CL2N2
Molecular Weight
209.110000
Exact Mass
208.053404
InChI
InChI=1S/C8H12N2.2ClH/c1-10(2)8-5-3-7(9)4-6-8;;/h3-6H,9H2,1-2H3;2*1H
InChIKey
IAEDWDXMFDKWFU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
59.68
TPSA
29.26

LogP / Solubility

WLOGP
2.18
MLOGP
1.92
XLogP3
2.18
Consensus LogP
2.09
Log S (ESOL)
-2.81
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.85
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.95
Class (SILICOS-IT)
Moderately 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)
-2.45

Drug-likeness / Medicinal Chemistry

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

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