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CAS 183736-74-5 CHCC Acid [6-Chloro-7-hydroxycouMarin-3-carboxylic acid] molecular structure lightbox
CAS RN: 183736-74-5

CHCC Acid [6-Chloro-7-hydroxycouMarin-3-carboxylic acid]

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260203 100mg In stock Shanghai Inquiry
Batchno.20260217 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20251209 1g In stock Shanghai Inquiry
Batchno.20260401 250mg In stock Shanghai Inquiry
  • Product code: SSC-084982
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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 183736-74-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

183736-74-5 / 6-chloro-7-hydroxy-2-oxochromene-3-carboxylic acid

Standard CAS: 183736-74-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
183736-74-5
Multi CAS
No
Molecular Formula
C10H5ClO5
Molecular Weight
240.590000
Exact Mass
239.982551
SMILES
C1=C2C=C(C(=O)OC2=CC(=C1Cl)O)C(=O)O
InChI
InChI=1S/C10H5ClO5/c11-6-2-4-1-5(9(13)14)10(15)16-8(4)3-7(6)12/h1-3,12H,(H,13,14)
InChIKey
WLIDEHHOQNJOIW-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
56.12
TPSA
87.74

LogP / Solubility

WLOGP
1.85
MLOGP
1.63
XLogP3
2.5
Consensus LogP
1.99
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.87
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.88
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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