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CAS 1082915-85-2 1-(4-BroMo-piperidin-1-yl)-ethanone molecular structure lightbox
CAS RN: 1082915-85-2

1-(4-BroMo-piperidin-1-yl)-ethanone

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260215 100mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-009615
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 8
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1082915-85-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 5 In Stock Beijing Inquiry
0.1g >95% 5 In Stock Shanghai Inquiry
0.25g -- 5 In Stock Beijing Inquiry
0.25g >95% 5 In Stock Beijing Inquiry
1g -- 5 In Stock Shanghai Inquiry
1g >95% 5 In Stock Shanghai Inquiry
5g -- 2 In Stock Shanghai Inquiry
5g >95% 2 In Stock Shenzhen Inquiry

1082915-85-2 / 1-(4-bromopiperidin-1-yl)ethanone

1-(4-bromopiperidin-1-yl)ethan-1-one | RefChem:425086 | 819-283-4

Standard CAS: 1082915-85-2 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1082915-85-2
Multi CAS
No
Molecular Formula
C7H12BrNO
Molecular Weight
206.080000
Exact Mass
205.010230
SMILES
CC(=O)N1CCC(CC1)Br
InChI
InChI=1S/C7H12BrNO/c1-6(10)9-4-2-7(8)3-5-9/h7H,2-5H2,1H3
InChIKey
IJQWPBRRNBHHRW-UHFFFAOYSA-N
Synonyms
1-(4-bromopiperidin-1-yl)ethan-1-one RefChem:425086 819-283-4 1-(4-bromopiperidin-1-yl)ethanone 1-(4-Bromo-piperidin-1-yl)-ethanone

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.86
H-bond acceptors
1
Molar refractivity
44.2
TPSA
20.31

LogP / Solubility

WLOGP
1.39
MLOGP
1.23
XLogP3
1
Consensus LogP
1.21
Log S (ESOL)
-1.99
Class (ESOL)
Soluble
Log S (Ali)
-2.26
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.16
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)
-2.99

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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