[email protected]
CAS 111359-62-7 2-Bromo-6-(methoxymethoxy)naphthalene molecular structure lightbox
CAS RN: 111359-62-7

2-Bromo-6-(methoxymethoxy)naphthalene

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260425 250mg / 1g / 5g / 10g Out of stock 5-7 business days Inquiry
  • Product code: SSC-012129
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: ＞97%
  • 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 111359-62-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

111359-62-7 / 2-bromo-6-(methoxymethoxy)naphthalene

2-Bromo-6-(methoxymethoxy)naphthalene | Naphthalene, 2-bromo-6-(methoxymethoxy)- | MFCD20927323

Standard CAS: 111359-62-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
111359-62-7
Multi CAS
No
Molecular Formula
C12H11BrO2
Molecular Weight
267.120000
Exact Mass
265.994240
SMILES
COCOC1=CC2=C(C=C1)C=C(C=C2)Br
InChI
InChI=1S/C12H11BrO2/c1-14-8-15-12-5-3-9-6-11(13)4-2-10(9)7-12/h2-7H,8H2,1H3
InChIKey
AMYQXFJYHRUYCH-UHFFFAOYSA-N
Synonyms
2-Bromo-6-(methoxymethoxy)naphthalene Naphthalene, 2-bromo-6-(methoxymethoxy)- MFCD20927323 SCHEMBL5829630 SCHEMBL29843581

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.17
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
64.15
TPSA
18.46

LogP / Solubility

WLOGP
3.59
MLOGP
3.16
XLogP3
3.8
Consensus LogP
3.52
Log S (ESOL)
-4.05
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.34
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.73
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

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

Customers Also Viewed

Get In Touch

Contact Us