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CAS 61702-44-1 2-Chloro-1,4-phenylenediamine sulfate molecular structure lightbox
CAS RN: 61702-44-1

2-Chloro-1,4-phenylenediamine sulfate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260529 100g In stock Inquiry
Batchno.20250428 2.5kg In stock Inquiry
Batchno.20251023 25g In stock Inquiry
Batchno.20260212 500g In stock Inquiry
  • Product code: SSC-170663
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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: ≥98%
  • 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 61702-44-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 0 Out of Stock Shanghai Inquiry

61702-44-1 / 2-chlorobenzene-1,4-diamine;sulfuric acid

Standard CAS: 61702-44-1 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
61702-44-1
Multi CAS
Yes
Molecular Formula
C6H9CLN2O4S
Molecular Weight
240.670000
Exact Mass
239.997156
InChI
InChI=1S/C6H7ClN2.H2O4S/c7-5-3-4(8)1-2-6(5)9;1-5(2,3)4/h1-3H,8-9H2;(H2,1,2,3,4)
InChIKey
GQFGHCRXPLROOF-UHFFFAOYSA-N

Physical Properties

Melting Point
484 to 487 °F (NTP, 1992)
Physical Description
2-chloro-p-phenylenediamine sulfate appears as light gray or lavender powder. (NTP, 1992)
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
H-bond acceptors
4
H-bond donors
4
Molar refractivity
54.45
TPSA
126.64

LogP / Solubility

WLOGP
0.85
MLOGP
0.75
XLogP3
0.85
Consensus LogP
0.82
Log S (ESOL)
-2.19
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.15
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.93
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.58

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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