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CAS 632-15-5 3,4-DIMETHYLTHIOPHENE molecular structure lightbox
CAS RN: 632-15-5

3,4-DIMETHYLTHIOPHENE

  • Product code: SSC-172786
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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, 10g, 5g, 25g
  • Available purity: >98%
  • Inventory rows with stock: 6
  • 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 632-15-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >98% 5 In Stock Shenzhen Inquiry
0.25g >98% 5 In Stock Shanghai Inquiry
1g >98% 5 In Stock Shenzhen Inquiry
10g >98% 4 In Stock Shanghai Inquiry
5g >98% 3 In Stock Shanghai Inquiry
25g >98% 2 In Stock Hong Kong Inquiry

632-15-5 / 3,4-dimethylthiophene

Standard CAS: 632-15-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
632-15-5
Multi CAS
Yes
Molecular Formula
C6H8S
Molecular Weight
112.190000
Exact Mass
112.034671
InChI
InChI=1S/C6H8S/c1-5-3-7-4-6(5)2/h3-4H,1-2H3
InChIKey
GPSFYJDZKSRMKZ-UHFFFAOYSA-N

Physical Properties

Boiling Point
144.00 to 146.00 °C. @ 760.00 mm Hg
Density
1.002-1.008 (20°)
Physical Description
Colourless to pale yellow liquid; Savoury roasted onion aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.33
H-bond acceptors
1
Molar refractivity
33.79
TPSA
28.2000

LogP / Solubility

WLOGP
2.36
MLOGP
2.07
XLogP3
2.3
Consensus LogP
2.24
Log S (ESOL)
-2.55
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.19
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
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)
-1.73

Drug-likeness / Medicinal Chemistry

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

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