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CAS 1121-60-4 2-Pyridinecarboxaldehyde molecular structure lightbox
CAS RN: 1121-60-4

2-Pyridinecarboxaldehyde

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251118 10g / 25g / 100g / 500g / 1kg Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei, Chongqing Inquiry
  • Product code: SSC-012585
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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, 10g, 25g, 100g
  • 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 1121-60-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 0 Out of Stock Shenzhen Inquiry
10g >98% 0 Out of Stock Beijing Inquiry
25g >98% 0 Out of Stock Shenzhen Inquiry
100g >98% 0 Out of Stock Beijing Inquiry

1121-60-4 / pyridine-2-carbaldehyde

2-Pyridinecarboxaldehyde | Picolinaldehyde | Pyridine-2-carbaldehyde

Standard CAS: 1121-60-4 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1121-60-4
Multi CAS
No
Molecular Formula
C6H5NO
Molecular Weight
107.110000
Exact Mass
107.037114
SMILES
C1=CC=NC(=C1)C=O
InChI
InChI=1S/C6H5NO/c8-5-6-3-1-2-4-7-6/h1-5H
InChIKey
CSDSSGBPEUDDEE-UHFFFAOYSA-N
Synonyms
2-Pyridinecarboxaldehyde Picolinaldehyde Pyridine-2-carbaldehyde 2-Formylpyridine Pyridine-2-aldehyde

Physical Properties

Physical Description
Yellow liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
29.62
TPSA
29.96

LogP / Solubility

WLOGP
0.89
MLOGP
0.78
XLogP3
0.4
Consensus LogP
0.69
Log S (ESOL)
-1.56
Class (ESOL)
Soluble
Log S (Ali)
-1.08
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.22
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)
-2.74

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

Safety & Transport

Pictogram(s)
Flammable Corrosive Acute Toxic Irritant Environmental Hazard
Signal
Danger
GHS Hazard Statements
H226 (17.1%): Flammable liquid and vapor [Warning Flammable liquids] H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (28.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H315 (71.1%): Causes skin irritation [Warning Skin corrosion/irritation] H317 (94.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P333+P317, P362+P364, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501

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