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CAS 17720-60-4 1-(2,4-DIHYDROXY-PHENYL)-2-(4-HYDROXY-PHENYL)-ETHANONE molecular structure lightbox
CAS RN: 17720-60-4

1-(2,4-DIHYDROXY-PHENYL)-2-(4-HYDROXY-PHENYL)-ETHANONE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251017 100mg In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260114 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250218 250mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251114 5g Out of stock Inquiry
  • Product code: SSC-077469
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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: 5g
  • 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 17720-60-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

17720-60-4 / 1-(2,4-dihydroxyphenyl)-2-(4-hydroxyphenyl)ethanone

Standard CAS: 17720-60-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
17720-60-4
Multi CAS
No
Molecular Formula
C14H12O4
Molecular Weight
244.240000
Exact Mass
244.073559
SMILES
C1=CC(=CC=C1CC(=O)C2=C(C=C(C=C2)O)O)O
InChI
InChI=1S/C14H12O4/c15-10-3-1-9(2-4-10)7-13(17)12-6-5-11(16)8-14(12)18/h1-6,8,15-16,18H,7H2
InChIKey
KLFCJXAPIFIIFR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
12
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
65.91
TPSA
77.76

LogP / Solubility

WLOGP
2.23
MLOGP
1.97
XLogP3
2.7
Consensus LogP
2.3
Log S (ESOL)
-3.05
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.17
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.46
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.63

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (90.9%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (90.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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