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CAS 152-72-7 Acenocoumarol molecular structure lightbox
CAS RN: 152-72-7

Acenocoumarol

Product Availability

Choose a grade to view its available package options.

9 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250722 25mg In stock Shanghai, Shandong Inquiry
Batchno.20251028 5mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250614 100mg In stock Shanghai Inquiry
Batchno.20250623 250mg In stock Shanghai Inquiry
Batchno.20250903 25mg In stock Shanghai Inquiry
Batchno.20260527 50mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250627 100mg In stock Inquiry
Batchno.20250903 25mg In stock Inquiry
Batchno.20260512 5mg In stock Inquiry
  • Product code: SSC-061796
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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: ≥97%
  • 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 152-72-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry

152-72-7 / 4-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]chromen-2-one

Standard CAS: 152-72-7 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
152-72-7
Multi CAS
No
Molecular Formula
C19H15NO6
Molecular Weight
353.300000
Exact Mass
353.089937
SMILES
CC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C2=C(C3=CC=CC=C3OC2=O)O
InChI
InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3
InChIKey
VABCILAOYCMVPS-UHFFFAOYSA-N

Physical Properties

Melting Point
196-199 196-199 °C 197 °C
Physical Description
Solid
Appearance
Crystals White crystaline powder OFF-WHITE TO LIGHT-TAN POWDER
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
16
Fraction Csp3
0.16
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
1
Molar refractivity
94.39
TPSA
110.65

LogP / Solubility

WLOGP
3.52
MLOGP
3.11
XLogP3
2.5
Consensus LogP
3.04
Log S (ESOL)
-4.37
Class (ESOL)
Slightly soluble
Log S (Ali)
-5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.48
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.38

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant Health Hazard
Signal
Danger
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (82.6%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (82.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (82.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H360 (13%): May damage fertility or the unborn child [Danger Reproductive toxicity]
Precautionary Statement Codes
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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