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CAS 13679-70-4 5-Methylthiophene-2-carboxaldehyde molecular structure lightbox
CAS RN: 13679-70-4

5-Methylthiophene-2-carboxaldehyde

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251105 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250422 10g In stock Shanghai, Shenzhen Inquiry
Batchno.20250428 1kg In stock Shanghai Inquiry
Batchno.20260213 25g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260326 500g In stock Shanghai, Tianjin Inquiry
Batchno.20251118 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260601 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-045813
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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, 1000g
  • Available purity: ≥98%
  • Inventory rows with stock: 4
  • 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 13679-70-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g -- 4 In Stock Shenzhen Inquiry
5g ≥98% 4 In Stock Beijing Inquiry
10g -- 1 In Stock Hong Kong Inquiry
10g ≥98% 1 In Stock Hong Kong Inquiry
25g -- 0 Out of Stock Beijing Inquiry
25g ≥98% 0 Out of Stock Hong Kong Inquiry
100g -- 0 Out of Stock Shenzhen Inquiry
100g ≥98% 0 Out of Stock Hong Kong Inquiry
1000g -- 0 Out of Stock Beijing Inquiry

13679-70-4 / 5-methylthiophene-2-carbaldehyde

Standard CAS: 13679-70-4 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
13679-70-4
Multi CAS
No
Molecular Formula
C6H6OS
Molecular Weight
126.180000
Exact Mass
126.013936
SMILES
CC1=CC=C(S1)C=O
InChI
InChI=1S/C6H6OS/c1-5-2-3-6(4-7)8-5/h2-4H,1H3
InChIKey
VAUMDUIUEPIGHM-UHFFFAOYSA-N

Physical Properties

Density
1.168-1.172
Physical Description
Pale yellow, gold, orange or dark brown liquid; roasted, nutty odour
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
34.44
TPSA
17.07

LogP / Solubility

WLOGP
1.87
MLOGP
1.64
XLogP3
1.8
Consensus LogP
1.77
Log S (ESOL)
-2.2
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.94
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.15
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)
-2.16

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (93%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P317, P330, and P501

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