CAS RN: 1421789-14-1

3-Amino-9,9-dimethylfluorene

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250222 100g In stock Shanghai Inquiry
Batchno.20250607 1g In stock Shanghai, Chengdu Inquiry
Batchno.20251212 250mg In stock Shanghai, Tianjin Inquiry
Batchno.20250131 250mg / 1g / 5g / 25g Out of stock 5-7 business days Inquiry
Batchno.20250825 25g In stock Shanghai Inquiry
Batchno.20250827 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS1421789-14-1
  • Purity/Analytical Methods: >99.0%
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1421789-14-1 / 9,9-dimethylfluoren-3-amine

Standard CAS: 1421789-14-1 Multi CAS: No

Basic Information

CAS
1421789-14-1
Multi CAS
No
Molecular Formula
C15H15N
Molecular Weight
209.290000
Exact Mass
209.120449
SMILES
CC1(C2=C(C=C(C=C2)N)C3=CC=CC=C31)C
InChI
InChI=1S/C15H15N/c1-15(2)13-6-4-3-5-11(13)12-9-10(16)7-8-14(12)15/h3-9H,16H2,1-2H3
InChIKey
GAGIQOAHYUJVFT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
68.42
TPSA
26.02

LogP / Solubility

WLOGP
3.58
MLOGP
3.15
XLogP3
3.7
Consensus LogP
3.48
Log S (ESOL)
-3.94
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.86
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.99
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.46

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

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