[email protected]
CAS 67169-22-6 2-METHYL-4-(TRIFLUOROMETHYL)ANILINE molecular structure lightbox
CAS RN: 67169-22-6

2-METHYL-4-(TRIFLUOROMETHYL)ANILINE

  • Product code: SSC-176805
GET A QUOTE
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, 1g, 0.25g, 25g, 100g
  • Available purity: >97%
  • Inventory rows with stock: 8
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 67169-22-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g -- 5 In Stock Shenzhen Inquiry
5g >97% 5 In Stock Shenzhen Inquiry
10g >97% 5 In Stock Shanghai Inquiry
10g -- 4 In Stock Shanghai Inquiry
1g -- 3 In Stock Shenzhen Inquiry
1g >97% 3 In Stock Shanghai Inquiry
0.25g -- 2 In Stock Shenzhen Inquiry
0.25g >97% 2 In Stock Hong Kong Inquiry
25g -- 0 Out of Stock Shenzhen Inquiry
25g >97% 0 Out of Stock Hong Kong Inquiry
100g -- 0 Out of Stock Shanghai Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry

67169-22-6 / 2-methyl-4-(trifluoromethyl)aniline

Standard CAS: 67169-22-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
67169-22-6
Multi CAS
No
Molecular Formula
C8F3H8N
Molecular Weight
175.150000
Exact Mass
175.060884
InChI
InChI=1S/C8H8F3N/c1-5-4-6(8(9,10)11)2-3-7(5)12/h2-4H,12H2,1H3
InChIKey
PAXQXJDYVORMOO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
1
H-bond donors
1
Molar refractivity
40.59
TPSA
26.02

LogP / Solubility

WLOGP
2.6
MLOGP
2.28
XLogP3
2.2
Consensus LogP
2.36
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.87
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.95
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)
-1.95

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

Customers Also Viewed

Get In Touch

Contact Us