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CAS 1198396-46-1 9-Bromo-7,7-dimethyl-7H-benzo[c]fluorene molecular structure lightbox
CAS RN: 1198396-46-1

9-Bromo-7,7-dimethyl-7H-benzo[c]fluorene

Product Availability

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251016 1g Out of stock 8-10 business days Inquiry
Batchno.20260329 200mg In stock Shanghai Inquiry
  • Product code: SSC-020626
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1198396-46-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Hong Kong Inquiry

1198396-46-1 / 9-bromo-7,7-dimethylbenzo[c]fluorene

9-bromo-7,7-dimethyl-7H-Benzo[c]fluorene | 9-Bromo-7,7-dimethyl-7H-benzo(c)fluorene | RefChem:549277

Standard CAS: 1198396-46-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1198396-46-1
Multi CAS
No
Molecular Formula
C19H15Br
Molecular Weight
323.200000
Exact Mass
322.035710
SMILES
CC1(C2=C(C3=C1C=C(C=C3)Br)C4=CC=CC=C4C=C2)C
InChI
InChI=1S/C19H15Br/c1-19(2)16-10-7-12-5-3-4-6-14(12)18(16)15-9-8-13(20)11-17(15)19/h3-11H,1-2H3
InChIKey
SNUKBTHMZLUJKR-UHFFFAOYSA-N
Synonyms
9-bromo-7,7-dimethyl-7H-Benzo[c]fluorene 9-Bromo-7,7-dimethyl-7H-benzo(c)fluorene RefChem:549277 810-981-4 9-bromo-7,7-dimethylbenzo[c]fluorene

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
16
Fraction Csp3
0.16
Molar refractivity
89.21
TPSA
0.0000

LogP / Solubility

WLOGP
5.91
MLOGP
5.21
XLogP3
6.4
Consensus LogP
5.84
Log S (ESOL)
-6.16
Class (ESOL)
Insoluble
Log S (Ali)
-6.48
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.67
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.5

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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