CAS RN: 4187-38-6

(R)-(+)-1-(4-Methylphenyl)ethylamine

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250131 1ml In stock Shanghai, Shandong Inquiry
Batchno.20251115 5ml Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251002 100g In stock Shanghai Inquiry
Batchno.20251021 1g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20250429 25g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260216 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: starshine_CAS4187-38-6
  • Purity/Analytical Methods: >99.0%
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4187-38-6 / 1-(4-methylphenyl)ethanamine

Standard CAS: 4187-38-6 Multi CAS: Yes

Basic Information

CAS
4187-38-6
Multi CAS
Yes
Molecular Formula
C9H13N
Molecular Weight
135.210000
Exact Mass
135.104799
InChI
InChI=1S/C9H13N/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8H,10H2,1-2H3
InChIKey
UZDDXUMOXKDXNE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
43.78
TPSA
26.02

LogP / Solubility

WLOGP
2.01
MLOGP
1.77
XLogP3
1.5
Consensus LogP
1.76
Log S (ESOL)
-2.33
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.33
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)
-2.11

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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