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CAS 1269292-40-1 Pyrrolidine, 2-(2-hydrazinylethyl)-1-methyl-, hydrochloride (1:1) molecular structure lightbox
CAS RN: 1269292-40-1

Pyrrolidine, 2-(2-hydrazinylethyl)-1-methyl-, hydrochloride (1:1)

  • Product code: SSC-034247
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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: ≥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 1269292-40-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1269292-40-1 / 2-(1-methylpyrrolidin-2-yl)ethylhydrazine;hydrochloride

Standard CAS: 1269292-40-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1269292-40-1
Multi CAS
No
Molecular Formula
C7H18ClN3
Molecular Weight
179.690000
Exact Mass
179.118925
SMILES
CN1CCCC1CCNN.Cl
InChI
InChI=1S/C7H17N3.ClH/c1-10-6-2-3-7(10)4-5-9-8;/h7,9H,2-6,8H2,1H3;1H
InChIKey
FINSQCLIXAZYAO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
49.71
TPSA
41.29

LogP / Solubility

WLOGP
0.36
MLOGP
0.31
XLogP3
0.36
Consensus LogP
0.34
Log S (ESOL)
-0.98
Class (ESOL)
Very soluble
Log S (Ali)
-1.29
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
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)
-3.56

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
2

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