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CAS 1126-10-9 Pyridazine-3-carboxylic acid ethyl ester molecular structure lightbox
CAS RN: 1126-10-9

Pyridazine-3-carboxylic acid ethyl ester

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250622 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-012948
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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 1126-10-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1126-10-9 / ethyl pyridazine-3-carboxylate

ethyl pyridazine-3-carboxylate | DTXSID50560467 | RefChem:344997

Standard CAS: 1126-10-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1126-10-9
Multi CAS
No
Molecular Formula
C7H8N2O2
Molecular Weight
152.150000
Exact Mass
152.058578
SMILES
CCOC(=O)C1=NN=CC=C1
InChI
InChI=1S/C7H8N2O2/c1-2-11-7(10)6-4-3-5-8-9-6/h3-5H,2H2,1H3
InChIKey
LLLVOBWNRQYTKR-UHFFFAOYSA-N
Synonyms
ethyl pyridazine-3-carboxylate DTXSID50560467 RefChem:344997 DTXCID80511245 3-Pyridazinecarboxylicacid, ethyl ester

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
4
Molar refractivity
37.99
TPSA
52.08

LogP / Solubility

WLOGP
0.65
MLOGP
0.57
XLogP3
-0.1
Consensus LogP
0.37
Log S (ESOL)
-1.47
Class (ESOL)
Soluble
Log S (Ali)
-1.28
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.43
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)
-3.18

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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