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CAS 3663-79-4 METHYL 1,4-BENZODIOXAN-2-CARBOXYLATE molecular structure lightbox
CAS RN: 3663-79-4

METHYL 1,4-BENZODIOXAN-2-CARBOXYLATE

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250204 1g In stock Shanghai Inquiry
Batchno.20260528 250mg In stock Shanghai Inquiry
Batchno.20250726 5g In stock Shanghai Inquiry
  • Product code: SSC-143843
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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: 5g, 1g, 0.1g, 0.25g
  • Available purity: >97%
  • Inventory rows with stock: 4
  • 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 3663-79-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 4 In Stock Shanghai Inquiry
1g >97% 3 In Stock Shenzhen Inquiry
0.1g >97% 1 In Stock Hong Kong Inquiry
0.25g >97% 1 In Stock Shenzhen Inquiry

3663-79-4 / methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Standard CAS: 3663-79-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3663-79-4
Multi CAS
Yes
Molecular Formula
C10H10O4
Molecular Weight
194.180000
Exact Mass
194.057909
InChI
InChI=1S/C10H10O4/c1-12-10(11)9-6-13-7-4-2-3-5-8(7)14-9/h2-5,9H,6H2,1H3
InChIKey
SNLAAGHHNZECPE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
48.37
TPSA
44.76

LogP / Solubility

WLOGP
1
MLOGP
0.88
XLogP3
1.7
Consensus LogP
1.19
Log S (ESOL)
-1.92
Class (ESOL)
Soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.87
Class (SILICOS-IT)
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)
-3.19

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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