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CAS 1060801-65-1 2-Chloro-5-methoxy-pyridine-4-carbaldehyde molecular structure lightbox
CAS RN: 1060801-65-1

2-Chloro-5-methoxy-pyridine-4-carbaldehyde

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260117 50mg / 100mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-007732
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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 1060801-65-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1060801-65-1 / 2-chloro-5-methoxypyridine-4-carbaldehyde

2-CHLORO-5-METHOXYISONICOTINALDEHYDE | MFCD13189002 | 2-CHLORO-5-METHOXY-PYRIDINE-4-CARBALDEHYDE

Standard CAS: 1060801-65-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1060801-65-1
Multi CAS
No
Molecular Formula
C7H6ClNO2
Molecular Weight
171.580000
Exact Mass
171.008706
SMILES
COC1=CN=C(C=C1C=O)Cl
InChI
InChI=1S/C7H6ClNO2/c1-11-6-3-9-7(8)2-5(6)4-10/h2-4H,1H3
InChIKey
UQVOGDSQASPDDH-UHFFFAOYSA-N
Synonyms
2-CHLORO-5-METHOXYISONICOTINALDEHYDE MFCD13189002 2-CHLORO-5-METHOXY-PYRIDINE-4-CARBALDEHYDE 2-chloro-5-methoxypyridine-4-carbaldehyde 2-Chloro-5-methoxy-4-pyridinecarboxaldehyde

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
41.19
TPSA
39.19

LogP / Solubility

WLOGP
1.56
MLOGP
1.37
XLogP3
1.2
Consensus LogP
1.38
Log S (ESOL)
-2.16
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.09
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.31
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)
-2.66

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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