[email protected]
CAS 104163-34-0 5-methyl-2-Thiophenemethanamine molecular structure lightbox
CAS RN: 104163-34-0

5-methyl-2-Thiophenemethanamine

Product Availability

Choose a grade to view its available package options.

1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250924 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-005929
GET A QUOTE
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: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 104163-34-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shanghai Inquiry

104163-34-0 / (5-methylthiophen-2-yl)methanamine

(5-methylthiophen-2-yl)methanamine | DTXSID50401841 | RefChem:404144

Standard CAS: 104163-34-0 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
104163-34-0
Multi CAS
Yes
Molecular Formula
C6H9NS
Molecular Weight
127.210000
Exact Mass
127.045570
SMILES
CC1=CC=C(S1)CN
InChI
InChI=1S/C6H9NS/c1-5-2-3-6(4-7)8-5/h2-3H,4,7H2,1H3
InChIKey
XCBYYXLOEBELSB-UHFFFAOYSA-N
Synonyms
(5-methylthiophen-2-yl)methanamine DTXSID50401841 RefChem:404144 DTXCID40352696 817-460-0

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
36.95
TPSA
26.02

LogP / Solubility

WLOGP
1.52
MLOGP
1.32
XLogP3
0.9
Consensus LogP
1.25
Log S (ESOL)
-1.98
Class (ESOL)
Soluble
Log S (Ali)
-1.7
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.86
Class (SILICOS-IT)
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)
-2.42

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)
Acute Toxic
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement Codes
P264, P270, P301+P316, P321, P330, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us