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CAS 1060815-67-9 6-Bromo-2-chloronicotinic acid molecular structure lightbox
CAS RN: 1060815-67-9

6-Bromo-2-chloronicotinic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250527 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: SSC-007882
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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 1060815-67-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1060815-67-9 / 6-bromo-2-chloropyridine-3-carboxylic acid

6-bromo-2-chloropyridine-3-carboxylic acid | DTXSID60673911 | 6-BROMO-2-CHLORO-3-PYRIDINECARBOXYLIC ACID

Standard CAS: 1060815-67-9 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1060815-67-9
Multi CAS
Yes
Molecular Formula
C6H3BrClNO2
Molecular Weight
236.450000
Exact Mass
234.903570
SMILES
C1=CC(=NC(=C1C(=O)O)Cl)Br
InChI
InChI=1S/C6H3BrClNO2/c7-4-2-1-3(6(10)11)5(8)9-4/h1-2H,(H,10,11)
InChIKey
CSHIGVLXOXJJMY-UHFFFAOYSA-N
Synonyms
6-bromo-2-chloropyridine-3-carboxylic acid DTXSID60673911 6-BROMO-2-CHLORO-3-PYRIDINECARBOXYLIC ACID RefChem:540712 DTXCID60624660

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
43.91
TPSA
50.19

LogP / Solubility

WLOGP
2.2
MLOGP
1.94
XLogP3
2.4
Consensus LogP
2.18
Log S (ESOL)
-3.03
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.08
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.14
Class (SILICOS-IT)
Poorly 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)
-2.6

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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