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CAS 1578-63-8 ALPHA-FLUOROPHENYLACETIC ACID molecular structure lightbox
CAS RN: 1578-63-8

ALPHA-FLUOROPHENYLACETIC ACID

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250704 1g In stock Inquiry
Batchno.20250222 250mg In stock Inquiry
Batchno.20251217 5g In stock Inquiry
  • Product code: SSC-066555
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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: ≥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 1578-63-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry
10g ≥95% 0 Out of Stock Beijing Inquiry
25g ≥95% 0 Out of Stock Beijing Inquiry

1578-63-8 / 2-fluoro-2-phenylacetic acid

Standard CAS: 1578-63-8 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1578-63-8
Multi CAS
No
Molecular Formula
C8H7FO2
Molecular Weight
154.140000
Exact Mass
154.043008
SMILES
C1=CC=C(C=C1)C(C(=O)O)F
InChI
InChI=1S/C8H7FO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)
InChIKey
ATPPNMLQNZHDOG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
37.93
TPSA
37.3

LogP / Solubility

WLOGP
1.78
MLOGP
1.56
XLogP3
1.9
Consensus LogP
1.75
Log S (ESOL)
-2.19
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.11
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.38
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)
-2.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H301 (97.9%): Toxic if swallowed [Danger Acute toxicity, oral] H311 (97.9%): Toxic in contact with skin [Danger Acute toxicity, dermal] H315 (12.8%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (12.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H331 (89.4%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501

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