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CAS 1198103-43-3 (6-(difluoroMethoxy)pyridin-3-yl)MethanaMine molecular structure lightbox
CAS RN: 1198103-43-3

(6-(difluoroMethoxy)pyridin-3-yl)MethanaMine

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260620 100mg In stock Shanghai Inquiry
Batchno.20250413 1g In stock Shanghai Inquiry
Batchno.20250111 250mg In stock Shanghai Inquiry
Batchno.20251115 5g In stock Shanghai Inquiry
  • Product code: SSC-020574
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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 1198103-43-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞95% 0 Out of Stock Shanghai Inquiry

1198103-43-3 / [6-(difluoromethoxy)-3-pyridinyl]methanamine

(6-(difluoromethoxy)pyridin-3-yl)methanamine | [6-(difluoromethoxy)pyridin-3-yl]methanamine | RefChem:404922

Standard CAS: 1198103-43-3 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1198103-43-3
Multi CAS
No
Molecular Formula
C7H8F2N2O
Molecular Weight
174.150000
Exact Mass
174.060469
SMILES
C1=CC(=NC=C1CN)OC(F)F
InChI
InChI=1S/C7H8F2N2O/c8-7(9)12-6-2-1-5(3-10)4-11-6/h1-2,4,7H,3,10H2
InChIKey
HSOFZBGNUGJSBV-UHFFFAOYSA-N
Synonyms
(6-(difluoromethoxy)pyridin-3-yl)methanamine [6-(difluoromethoxy)pyridin-3-yl]methanamine RefChem:404922 831-195-8 MFCD18259135

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
38.76
TPSA
48.14

LogP / Solubility

WLOGP
1.14
MLOGP
1
XLogP3
1
Consensus LogP
1.05
Log S (ESOL)
-1.81
Class (ESOL)
Soluble
Log S (Ali)
-1.81
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.1
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)
-2.97

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive Irritant
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501

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