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CAS 32316-90-8 3,4′-Biphenyldiamine molecular structure lightbox
CAS RN: 32316-90-8

3,4′-Biphenyldiamine

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260117 100mg In stock Shenzhen, Tianjin Inquiry
Batchno.20250609 1g In stock Tianjin, Wuhan Inquiry
Batchno.20250616 250mg In stock Shenzhen, Tianjin Inquiry
Batchno.20260621 5g In stock Tianjin, Wuhan Inquiry
  • Product code: starshine_CAS32316-90-8
  • Purity/Analytical Methods: >99.0%
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32316-90-8 / 3-(4-aminophenyl)aniline

Standard CAS: 32316-90-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
32316-90-8
Multi CAS
No
Molecular Formula
C12H12N2
Molecular Weight
184.240000
Exact Mass
184.100048
InChI
InChI=1S/C12H12N2/c13-11-6-4-9(5-7-11)10-2-1-3-12(14)8-10/h1-8H,13-14H2
InChIKey
QSPMTSAELLSLOQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
60.7
TPSA
52.04

LogP / Solubility

WLOGP
2.52
MLOGP
2.21
XLogP3
2.2
Consensus LogP
2.31
Log S (ESOL)
-3.14
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.89
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.07
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.06

Drug-likeness / Medicinal Chemistry

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

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