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CAS 1150617-92-7 2-chloro-5,6-dihydrocyclopenta[b]pyridin-7-one molecular structure lightbox
CAS RN: 1150617-92-7

2-chloro-5,6-dihydrocyclopenta[b]pyridin-7-one

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250521 100mg / 250mg / 1g / 5g / 10g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-014787
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Verified Factory Data

Supply Overview & Packaging Options

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  • Pack sizes on record: 1g, 0.1g, 0.25g, 5g, 10g, 25g
  • Available purity: ≥97%
  • Inventory rows with stock: 10
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

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Recorded sizes, purity and stock details for CAS 1150617-92-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 3 In Stock Beijing Inquiry
1g ≥97% 3 In Stock Hong Kong Inquiry
0.1g -- 1 In Stock Hong Kong Inquiry
0.1g ≥97% 1 In Stock Shenzhen Inquiry
0.25g -- 1 In Stock Beijing Inquiry
0.25g ≥97% 1 In Stock Beijing Inquiry
5g -- 1 In Stock Beijing Inquiry
5g ≥97% 1 In Stock Shenzhen Inquiry
10g -- 1 In Stock Shenzhen Inquiry
10g ≥97% 1 In Stock Shenzhen Inquiry
25g -- 0 Out of Stock Shanghai Inquiry
25g ≥97% 0 Out of Stock Shenzhen Inquiry

1150617-92-7 / 2-chloro-5,6-dihydrocyclopenta[b]pyridin-7-one

2-chloro-5H,6H,7H-cyclopenta[b]pyridin-7-one | 2-chloro-5H,6H,7H-cyclopenta(b)pyridin-7-one | RefChem:469468

Standard CAS: 1150617-92-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1150617-92-7
Multi CAS
No
Molecular Formula
C8H6ClNO
Molecular Weight
167.590000
Exact Mass
167.013792
SMILES
C1CC(=O)C2=C1C=CC(=N2)Cl
InChI
InChI=1S/C8H6ClNO/c9-7-4-2-5-1-3-6(11)8(5)10-7/h2,4H,1,3H2
InChIKey
LFTCYZANBKFQRY-UHFFFAOYSA-N
Synonyms
2-chloro-5H,6H,7H-cyclopenta[b]pyridin-7-one 2-chloro-5H,6H,7H-cyclopenta(b)pyridin-7-one RefChem:469468 826-974-4 2-chloro-5,6-dihydrocyclopenta[b]pyridin-7-one

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
H-bond acceptors
2
Molar refractivity
41.9
TPSA
29.96

LogP / Solubility

WLOGP
1.86
MLOGP
1.64
XLogP3
1.9
Consensus LogP
1.8
Log S (ESOL)
-2.46
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.28
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.3
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)
-2.42

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

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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