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CAS 74877-10-4 1-(4-FLUORO-PHENYL)-PROPYLAMINE molecular structure lightbox
CAS RN: 74877-10-4

1-(4-FLUORO-PHENYL)-PROPYLAMINE

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260309 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS74877-10-4
  • Purity/Analytical Methods: >99.0%
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74877-10-4 / 1-(4-fluorophenyl)propan-1-amine

Standard CAS: 74877-10-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
74877-10-4
Multi CAS
Yes
Molecular Formula
C9FH12N
Molecular Weight
153.200000
Exact Mass
153.095378
InChI
InChI=1S/C9H12FN/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,9H,2,11H2,1H3
InChIKey
BWZFVQWUKNCKQL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
43.62
TPSA
26.02

LogP / Solubility

WLOGP
2.24
MLOGP
1.96
XLogP3
1.8
Consensus LogP
2
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.75
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)
-2.07

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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