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CAS 60410-99-3 2,2′-Dimethyl-1,1′-biphenyl-4,4′-diamine dihydrochloride molecular structure lightbox
CAS RN: 60410-99-3

2,2′-Dimethyl-1,1′-biphenyl-4,4′-diamine dihydrochloride

  • Product code: SSC-169001
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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: ≥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 60410-99-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

60410-99-3 / 4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride

Standard CAS: 60410-99-3 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
60410-99-3
Multi CAS
Yes
Molecular Formula
C14H18CL2N2
Molecular Weight
285.200000
Exact Mass
284.084704
InChI
InChI=1S/C14H16N2.2ClH/c1-9-7-11(15)3-5-13(9)14-6-4-12(16)8-10(14)2;;/h3-8H,15-16H2,1-2H3;2*1H
InChIKey
UGBRWPHXDCDHIM-UHFFFAOYSA-N

Physical Properties

Physical Description
3,3'-dimethylbenzidine dihydrochloride is a light tan powder. (NTP, 1992) Light tan solid; [CAMEO] Light red powder; Hygroscopic
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
84.67
TPSA
52.04

LogP / Solubility

WLOGP
3.98
MLOGP
3.51
XLogP3
3.98
Consensus LogP
3.82
Log S (ESOL)
-4.54
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.77
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.94
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.64

Drug-likeness / Medicinal Chemistry

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

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