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CAS 1128-74-1 7-Fluoro-2-methylquinoline molecular structure lightbox
CAS RN: 1128-74-1

7-Fluoro-2-methylquinoline

  • Product code: SSC-013098
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 0.1g, 0.25g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 12
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1128-74-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 5 In Stock Shanghai Inquiry
1g >97% 5 In Stock Hong Kong Inquiry
5g -- 4 In Stock Shanghai Inquiry
5g >97% 4 In Stock Beijing Inquiry
0.1g -- 2 In Stock Shanghai Inquiry
0.1g >97% 2 In Stock Hong Kong Inquiry
0.25g -- 2 In Stock Beijing Inquiry
0.25g >97% 2 In Stock Beijing Inquiry
10g -- 2 In Stock Hong Kong Inquiry
10g >97% 2 In Stock Hong Kong Inquiry
25g -- 1 In Stock Beijing Inquiry
25g >97% 1 In Stock Shanghai Inquiry

1128-74-1 / 7-fluoro-2-methylquinoline

7-Fluoro-2-methylquinoline | AYSKNDXTWPNRKG-UHFFFAOYSA- | DTXSID80381263

Standard CAS: 1128-74-1 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1128-74-1
Multi CAS
Yes
Molecular Formula
C10H8FN
Molecular Weight
161.180000
Exact Mass
161.064077
SMILES
CC1=NC2=C(C=C1)C=CC(=C2)F
InChI
InChI=1S/C10H8FN/c1-7-2-3-8-4-5-9(11)6-10(8)12-7/h2-6H,1H3
InChIKey
AYSKNDXTWPNRKG-UHFFFAOYSA-N
Synonyms
7-Fluoro-2-methylquinoline AYSKNDXTWPNRKG-UHFFFAOYSA- DTXSID80381263 RefChem:106085 DTXCID10332288

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
10
Fraction Csp3
0.1
H-bond acceptors
1
Molar refractivity
46.44
TPSA
12.89

LogP / Solubility

WLOGP
2.68
MLOGP
2.36
XLogP3
2.7
Consensus LogP
2.58
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.82
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.93
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)
-1.8

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)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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