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CAS 1125-60-6 5-Aminoisoquinoline molecular structure lightbox
CAS RN: 1125-60-6

5-Aminoisoquinoline

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251211 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Guangdong, Hebei 8-10 business days Inquiry
  • Product code: SSC-012901
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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, 5g, 10g, 25g
  • 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 1125-60-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >98% 0 Out of Stock Hong Kong Inquiry
5g >98% 0 Out of Stock Beijing Inquiry
10g >98% 0 Out of Stock Beijing Inquiry
25g >98% 0 Out of Stock Shenzhen Inquiry

1125-60-6 / isoquinolin-5-amine

5-Aminoisoquinoline | isoquinolin-5-amine | 5-Isoquinolinamine

Standard CAS: 1125-60-6 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1125-60-6
Multi CAS
Yes
Molecular Formula
C9H8N2
Molecular Weight
144.170000
Exact Mass
144.068748
SMILES
C1=CC2=C(C=CN=C2)C(=C1)N
InChI
InChI=1S/C9H8N2/c10-9-3-1-2-7-6-11-5-4-8(7)9/h1-6H,10H2
InChIKey
DTVYNUOOZIKEEX-UHFFFAOYSA-N
Synonyms
5-Aminoisoquinoline isoquinolin-5-amine 5-Isoquinolinamine Isoquinol-5-ylamine LDJ0JLN1Y7

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
10
H-bond acceptors
2
H-bond donors
1
Molar refractivity
46.16
TPSA
38.91

LogP / Solubility

WLOGP
1.82
MLOGP
1.59
XLogP3
1.4
Consensus LogP
1.6
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.05
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.11
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.31

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)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (12.8%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (97.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (95.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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