[email protected]
CAS 1003710-18-6 4-AMINO-2-CHLORO-3-FLUOROPHENOL molecular structure lightbox
CAS RN: 1003710-18-6

4-AMINO-2-CHLORO-3-FLUOROPHENOL

Product Availability

Choose a grade to view its available package options.

2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250718 1g In stock Inquiry
Batchno.20250823 250mg In stock Inquiry
  • Product code: SSC-000904
GET A QUOTE
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: 0.1g, 0.25g
  • Available purity: >95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 1003710-18-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 0 Out of Stock Shanghai Inquiry
0.25g >95% 0 Out of Stock Shanghai Inquiry

1003710-18-6 / 4-amino-2-chloro-3-fluorophenol

4-amino-2-chloro-3-fluorophenol | Phenol, 4-Amino-2-Chloro-3-Fluoro- | MFCD09996949

Standard CAS: 1003710-18-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1003710-18-6
Multi CAS
Yes
Molecular Formula
C6H5ClFNO
Molecular Weight
161.560000
Exact Mass
161.004370
SMILES
C1=CC(=C(C(=C1N)F)Cl)O
InChI
InChI=1S/C6H5ClFNO/c7-5-4(10)2-1-3(9)6(5)8/h1-2,10H,9H2
InChIKey
FEIRBFCWDDTCEQ-UHFFFAOYSA-N
Synonyms
4-amino-2-chloro-3-fluorophenol Phenol, 4-Amino-2-Chloro-3-Fluoro- MFCD09996949 4-amino-2-chloro-3-fluoro-phenol SCHEMBL4847774

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
2
H-bond donors
2
Molar refractivity
37.49
TPSA
46.25

LogP / Solubility

WLOGP
1.77
MLOGP
1.55
XLogP3
1.6
Consensus LogP
1.64
Log S (ESOL)
-2.4
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.16
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.18
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)
-2.45

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

Customers Also Viewed

Get In Touch

Contact Us