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CAS 529512-80-9 5-Chloro-2-fluorophenylhydrazine hydrochloride molecular structure lightbox
CAS RN: 529512-80-9

5-Chloro-2-fluorophenylhydrazine hydrochloride

  • Product code: SSC-160118
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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: ＞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 529512-80-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞95% 0 Out of Stock Hong Kong Inquiry

529512-80-9 / (5-chloro-2-fluorophenyl)hydrazine;hydrochloride

Standard CAS: 529512-80-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
529512-80-9
Multi CAS
No
Molecular Formula
C6H7CL2FN2
Molecular Weight
197.030000
Exact Mass
195.997032
InChI
InChI=1S/C6H6ClFN2.ClH/c7-4-1-2-5(8)6(3-4)10-9;/h1-3,10H,9H2;1H
InChIKey
XYWXFBGIZMKSDU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
46.47
TPSA
38.05

LogP / Solubility

WLOGP
2.19
MLOGP
1.92
XLogP3
2.19
Consensus LogP
2.1
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.75
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.88
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)
-2.37

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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