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CAS 762240-99-3 1-(Chloroacetyl)-2-(trifluoroacetyl)hydrazine molecular structure lightbox
CAS RN: 762240-99-3

1-(Chloroacetyl)-2-(trifluoroacetyl)hydrazine

  • Product code: SSC-185661
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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: ＞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 762240-99-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

762240-99-3 / N'-(2-chloroacetyl)-2,2,2-trifluoroacetohydrazide

Standard CAS: 762240-99-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
762240-99-3
Multi CAS
No
Molecular Formula
C4H4CLF3N2O2
Molecular Weight
204.530000
Exact Mass
203.991340
InChI
InChI=1S/C4H4ClF3N2O2/c5-1-2(11)9-10-3(12)4(6,7)8/h1H2,(H,9,11)(H,10,12)
InChIKey
DYKIVKLXFDNBMY-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
33.06
TPSA
58.2

LogP / Solubility

WLOGP
-0.07
MLOGP
-0.06
XLogP3
0.8
Consensus LogP
0.22
Log S (ESOL)
-1
Class (ESOL)
Soluble
Log S (Ali)
-1.19
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.06
Class (SILICOS-IT)
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)
-4.01

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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