[email protected]
CAS 149777-00-4 Dimethyl Tetrahydropyran-4,4-dicarboxylate molecular structure lightbox
CAS RN: 149777-00-4

Dimethyl Tetrahydropyran-4,4-dicarboxylate

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250330 1g In stock Inquiry
Batchno.20250304 25g In stock Inquiry
Batchno.20250509 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250901 5g In stock Shanghai Inquiry
  • Product code: SSC-059715
GET A QUOTE
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: 1g, 5g, 10g, 0.25g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 5
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 149777-00-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Hong Kong Inquiry
5g >97% 3 In Stock Beijing Inquiry
10g >97% 3 In Stock Shenzhen Inquiry
0.25g >97% 2 In Stock Shenzhen Inquiry
25g >97% 1 In Stock Beijing Inquiry

149777-00-4 / dimethyl oxane-4,4-dicarboxylate

Standard CAS: 149777-00-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
149777-00-4
Multi CAS
No
Molecular Formula
C9H14O5
Molecular Weight
202.200000
Exact Mass
202.084124
SMILES
COC(=O)C1(CCOCC1)C(=O)OC
InChI
InChI=1S/C9H14O5/c1-12-7(10)9(8(11)13-2)3-5-14-6-4-9/h3-6H2,1-2H3
InChIKey
OTIZXJJKKRZQJR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.78
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
46.52
TPSA
61.83

LogP / Solubility

WLOGP
0.13
MLOGP
0.11
XLogP3
0.3
Consensus LogP
0.18
Log S (ESOL)
-1.04
Class (ESOL)
Soluble
Log S (Ali)
-1.31
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.32
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)
-3.86

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us