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CAS 1006-94-6 5-Methoxyindole molecular structure lightbox
CAS RN: 1006-94-6

5-Methoxyindole

Product Availability

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10 package records10 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260121 100g In stock Inquiry
Batchno.20250917 1g In stock Inquiry
Batchno.20250216 25g In stock Inquiry
Batchno.20251126 500g In stock Inquiry
Batchno.20250830 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260204 100g In stock Shanghai, Shandong Inquiry
Batchno.20250803 1g In stock Shanghai, Shandong, Chongqing Inquiry
Batchno.20251214 25g In stock Shanghai, Chongqing Inquiry
Batchno.20250415 5g In stock Shanghai, Shandong, Guangdong, Chongqing Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250326 5g In stock Shanghai Inquiry
  • Product code: SSC-001211
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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: 5g, 10g, 25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 1
  • 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 1006-94-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 1 In Stock Shenzhen Inquiry
10g >97% 0 Out of Stock Beijing Inquiry
25g >97% 0 Out of Stock Shenzhen Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry

1006-94-6 / 5-methoxy-1H-indole

5-METHOXYINDOLE | 5-Methoxy-1H-indole | 1H-Indole, 5-methoxy-

Standard CAS: 1006-94-6 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1006-94-6
Multi CAS
Yes
Molecular Formula
C9H9NO
Molecular Weight
147.170000
Exact Mass
147.068414
SMILES
COC1=CC2=C(C=C1)NC=C2
InChI
InChI=1S/C9H9NO/c1-11-8-2-3-9-7(6-8)4-5-10-9/h2-6,10H,1H3
InChIKey
DWAQDRSOVMLGRQ-UHFFFAOYSA-N
Synonyms
5-METHOXYINDOLE 5-Methoxy-1H-indole 1H-Indole, 5-methoxy- Femedol Indole, 5-methoxy-

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
44.85
TPSA
25.02

LogP / Solubility

WLOGP
2.18
MLOGP
1.91
XLogP3
2.1
Consensus LogP
2.06
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.34
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.54
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
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
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (96.2%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (96.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (94.2%): 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

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