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CAS 1092350-77-0 7-BROMO-8-FLUORO-2,3-DIHYDRO-1-BENZOPYRAN-4-ONE molecular structure lightbox
CAS RN: 1092350-77-0

7-BROMO-8-FLUORO-2,3-DIHYDRO-1-BENZOPYRAN-4-ONE

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250715 100mg In stock Shanghai Inquiry
Batchno.20250530 1g In stock Shanghai Inquiry
Batchno.20251129 250mg In stock Shanghai Inquiry
Batchno.20250210 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260624 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: SSC-010388
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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: ≥95%
  • 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 1092350-77-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

1092350-77-0 / 7-bromo-8-fluoro-2,3-dihydrochromen-4-one

7-bromo-8-fluoro-3,4-dihydro-2H-1-benzopyran-4-one | RefChem:545911 | 823-247-3

Standard CAS: 1092350-77-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1092350-77-0
Multi CAS
No
Molecular Formula
C9H6BrFO2
Molecular Weight
245.040000
Exact Mass
243.953520
SMILES
C1COC2=C(C1=O)C=CC(=C2F)Br
InChI
InChI=1S/C9H6BrFO2/c10-6-2-1-5-7(12)3-4-13-9(5)8(6)11/h1-2H,3-4H2
InChIKey
KPAFVSLIXPVEOJ-UHFFFAOYSA-N
Synonyms
7-bromo-8-fluoro-3,4-dihydro-2H-1-benzopyran-4-one RefChem:545911 823-247-3 7-bromo-8-fluorochroman-4-one MFCD11518510

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
H-bond acceptors
2
Molar refractivity
48.54
TPSA
26.3

LogP / Solubility

WLOGP
2.55
MLOGP
2.25
XLogP3
2.2
Consensus LogP
2.33
Log S (ESOL)
-3.31
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.41
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.37
Class (SILICOS-IT)
Poorly 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)
-2.4

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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