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CAS 108938-16-5 7-BROMO-5-METHYL-1H-INDOLE-2,3-DIONE molecular structure lightbox
CAS RN: 108938-16-5

7-BROMO-5-METHYL-1H-INDOLE-2,3-DIONE

Product Availability

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3 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251214 1g In stock Inquiry
Batchno.20250319 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260529 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-010139
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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: 0.1g, 0.25g, 1g, 5g, 10g
  • Available purity: ≥95%
  • Inventory rows with stock: 5
  • 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 108938-16-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥95% 5 In Stock Hong Kong Inquiry
0.25g ≥95% 5 In Stock Hong Kong Inquiry
1g ≥95% 5 In Stock Shenzhen Inquiry
5g ≥95% 5 In Stock Hong Kong Inquiry
10g ≥95% 1 In Stock Shanghai Inquiry

108938-16-5 / 7-bromo-5-methyl-1H-indole-2,3-dione

7-BROMO-5-METHYL-2,3-DIHYDRO-1H-INDOLE-2,3-DIONE | RefChem:545865 | 808-771-2

Standard CAS: 108938-16-5 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
108938-16-5
Multi CAS
No
Molecular Formula
C9H6BrNO2
Molecular Weight
240.050000
Exact Mass
238.958190
SMILES
CC1=CC2=C(C(=C1)Br)NC(=O)C2=O
InChI
InChI=1S/C9H6BrNO2/c1-4-2-5-7(6(10)3-4)11-9(13)8(5)12/h2-3H,1H3,(H,11,12,13)
InChIKey
NPDJRIGMWAQKTQ-UHFFFAOYSA-N
Synonyms
7-BROMO-5-METHYL-2,3-DIHYDRO-1H-INDOLE-2,3-DIONE RefChem:545865 808-771-2 7-Bromo-5-methylindoline-2,3-dione 7-bromo-5-methylisatin

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.11
H-bond acceptors
2
H-bond donors
1
Molar refractivity
51.84
TPSA
46.17

LogP / Solubility

WLOGP
1.89
MLOGP
1.67
XLogP3
1.8
Consensus LogP
1.79
Log S (ESOL)
-2.86
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.89
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
Class (SILICOS-IT)
Moderately 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)
-2.84

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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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