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CAS 1141-35-1 2-(4-CHLORO-PHENYL)-BENZOOXAZOLE molecular structure lightbox
CAS RN: 1141-35-1

2-(4-CHLORO-PHENYL)-BENZOOXAZOLE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250911 250mg Out of stock Inquiry
  • Product code: SSC-013995
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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: ＞97%
  • 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 1141-35-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1141-35-1 / 2-(4-chlorophenyl)-1,3-benzoxazole

2-(4-Chlorophenyl)benzoxazole | BENZOXAZOLE, 2-(p-CHLOROPHENYL)- | CWX8HK6VVA

Standard CAS: 1141-35-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1141-35-1
Multi CAS
No
Molecular Formula
C13H8ClNO
Molecular Weight
229.660000
Exact Mass
229.029442
SMILES
C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C13H8ClNO/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H
InChIKey
NTMAGNRMERGORC-UHFFFAOYSA-N
Synonyms
2-(4-Chlorophenyl)benzoxazole BENZOXAZOLE, 2-(p-CHLOROPHENYL)- CWX8HK6VVA DTXSID80150653 RefChem:84390

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
15
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
64.46
TPSA
26.03

LogP / Solubility

WLOGP
4.15
MLOGP
3.65
XLogP3
4.1
Consensus LogP
3.97
Log S (ESOL)
-4.51
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.44
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.72
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)
-1.18

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
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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