[email protected]
CAS 38941-98-9 4-(tert-Butyl)-2-iodophenol molecular structure lightbox
CAS RN: 38941-98-9

4-(tert-Butyl)-2-iodophenol

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250322 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250712 250mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20260323 25g In stock Shanghai, Tianjin Inquiry
Batchno.20260131 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-146545
GET A QUOTE
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: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 38941-98-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

38941-98-9 / 4-tert-butyl-2-iodophenol

Standard CAS: 38941-98-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
38941-98-9
Multi CAS
No
Molecular Formula
C10H13IO
Molecular Weight
276.110000
Exact Mass
276.001110
InChI
InChI=1S/C10H13IO/c1-10(2,3)7-4-5-9(12)8(11)6-7/h4-6,12H,1-3H3
InChIKey
DTNQNHHVSJPDSG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
59.52
TPSA
20.23

LogP / Solubility

WLOGP
3.29
MLOGP
2.91
XLogP3
3.9
Consensus LogP
3.37
Log S (ESOL)
-4
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.2
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.19
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)
-2.07

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us