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CAS 136630-36-9 4,4′-dibroMobiphenyl-2,2′-diaMine molecular structure lightbox
CAS RN: 136630-36-9

4,4′-dibroMobiphenyl-2,2′-diaMine

Product Availability

Choose a grade to view its available package options.

9 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251126 1g In stock Inquiry
Batchno.20250124 250mg In stock Inquiry
Batchno.20250125 25g In stock Inquiry
Batchno.20251231 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251125 100g Out of stock Inquiry
Batchno.20250602 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250216 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20260518 25g In stock Shanghai, Chengdu Inquiry
Batchno.20260616 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-045665
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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: 5g
  • 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 136630-36-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Beijing Inquiry

136630-36-9 / 2-(2-amino-4-bromophenyl)-5-bromoaniline

Standard CAS: 136630-36-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
136630-36-9
Multi CAS
No
Molecular Formula
C12H10Br2N2
Molecular Weight
342.030000
Exact Mass
341.919020
SMILES
C1=CC(=C(C=C1Br)N)C2=C(C=C(C=C2)Br)N
InChI
InChI=1S/C12H10Br2N2/c13-7-1-3-9(11(15)5-7)10-4-2-8(14)6-12(10)16/h1-6H,15-16H2
InChIKey
KZDMFBDNQPKWNM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
76.1
TPSA
52.04

LogP / Solubility

WLOGP
4.04
MLOGP
3.57
XLogP3
3.6
Consensus LogP
3.74
Log S (ESOL)
-5
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.28
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.36
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.94

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

Safety & Transport

Pictogram(s)
Corrosive Irritant Environmental Hazard
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P391, P403+P233, P405, and P501

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