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CAS 1256619-51-8 7-BroMo-9,9-diMethyl-2-fluorenol molecular structure lightbox
CAS RN: 1256619-51-8

7-BroMo-9,9-diMethyl-2-fluorenol

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250929 100mg In stock Shanghai Inquiry
Batchno.20250826 100mg / 250mg / 1g / 5g Out of stock 5-7 business days Inquiry
Batchno.20260621 1g In stock Shanghai, Tianjin Inquiry
Batchno.20251026 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260204 5g In stock Shenzhen, Tianjin Inquiry
  • Product code: starshine_CAS1256619-51-8
  • Purity/Analytical Methods: >99.0%
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1256619-51-8 / 7-bromo-9,9-dimethylfluoren-2-ol

Standard CAS: 1256619-51-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1256619-51-8
Multi CAS
No
Molecular Formula
C15H13BrO
Molecular Weight
289.170000
Exact Mass
288.014980
SMILES
CC1(C2=C(C=CC(=C2)O)C3=C1C=C(C=C3)Br)C
InChI
InChI=1S/C15H13BrO/c1-15(2)13-7-9(16)3-5-11(13)12-6-4-10(17)8-14(12)15/h3-8,17H,1-2H3
InChIKey
KQMBUZYVUMQEAG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
12
Fraction Csp3
0.2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
73.37
TPSA
20.23

LogP / Solubility

WLOGP
4.46
MLOGP
3.94
XLogP3
4.8
Consensus LogP
4.4
Log S (ESOL)
-4.97
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.15
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.24
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.32

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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