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CAS 1801989-93-4 1H-Xanthene-4-carboxaldehyde, 2,3-dihydro-6-methoxy- molecular structure lightbox
CAS RN: 1801989-93-4

1H-Xanthene-4-carboxaldehyde, 2,3-dihydro-6-methoxy-

  • Product code: SSC-080605
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 8
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1801989-93-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 2 In Stock Shenzhen Inquiry
0.1g ≥95% 2 In Stock Shenzhen Inquiry
0.25g -- 2 In Stock Beijing Inquiry
0.25g ≥95% 2 In Stock Shanghai Inquiry
1g -- 2 In Stock Shanghai Inquiry
1g ≥95% 2 In Stock Shenzhen Inquiry
5g -- 2 In Stock Shanghai Inquiry
5g ≥95% 2 In Stock Hong Kong Inquiry

1801989-93-4 / 6-methoxy-2,3-dihydro-1H-xanthene-4-carbaldehyde

Standard CAS: 1801989-93-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1801989-93-4
Multi CAS
No
Molecular Formula
C15H14O3
Molecular Weight
242.270000
Exact Mass
242.094294
SMILES
COC1=CC2=C(C=C1)C=C3CCCC(=C3O2)C=O
InChI
InChI=1S/C15H14O3/c1-17-13-6-5-10-7-11-3-2-4-12(9-16)15(11)18-14(10)8-13/h5-9H,2-4H2,1H3
InChIKey
ZNDPVCFUJXFVJE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.27
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
68.54
TPSA
35.53

LogP / Solubility

WLOGP
3.11
MLOGP
2.74
XLogP3
2.4
Consensus LogP
2.75
Log S (ESOL)
-3.41
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.79
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.05
Class (SILICOS-IT)
Slightly 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)
-1.99

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

Applications of CAS 1801989-93-4

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1801989-93-4 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

Storage & Handling

Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.

Quotation & Packaging

Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.

Quality & Compliance

Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.

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