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CAS 10447-11-7 4-METHYL-1-NAPHTHALENESULFONYL CHLORIDE molecular structure lightbox
CAS RN: 10447-11-7

4-METHYL-1-NAPHTHALENESULFONYL CHLORIDE

Product Availability

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3 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251019 100mg Out of stock Inquiry
Batchno.20251121 250mg Out of stock Inquiry
Batchno.20250628 50mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-006231
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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: 1g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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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 10447-11-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

10447-11-7 / 4-methylnaphthalene-1-sulfonyl chloride

4-methylnaphthalene-1-sulfonyl Chloride | 4-METHYL-1-NAPHTHALENESULFONYL CHLORIDE | MFCD02677693

Standard CAS: 10447-11-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
10447-11-7
Multi CAS
No
Molecular Formula
C11H9ClO2S
Molecular Weight
240.710000
Exact Mass
240.001178
SMILES
CC1=CC=C(C2=CC=CC=C12)S(=O)(=O)Cl
InChI
InChI=1S/C11H9ClO2S/c1-8-6-7-11(15(12,13)14)10-5-3-2-4-9(8)10/h2-7H,1H3
InChIKey
WLEBLSWMOQCGTE-UHFFFAOYSA-N
Synonyms
4-methylnaphthalene-1-sulfonyl Chloride 4-METHYL-1-NAPHTHALENESULFONYL CHLORIDE MFCD02677693 4-Methylnaphthalene-1-sulphonyl chloride 1-(Chlorosulphonyl)-4-methylnaphthalene

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.09
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
61.72
TPSA
34.14

LogP / Solubility

WLOGP
3.08
MLOGP
2.71
XLogP3
3.6
Consensus LogP
3.13
Log S (ESOL)
-3.7
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.75
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.9
Class (SILICOS-IT)
Poorly 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)
-2

Drug-likeness / Medicinal Chemistry

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

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