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CAS 89-98-5 2-Chlorobenzaldehyde molecular structure lightbox
CAS RN: 89-98-5

2-Chlorobenzaldehyde

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250802 100g / 500g / 2.5kg / 10kg / 25kg Confirm by inquiry Shanghai, Guangdong, Chongqing, Hebei, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251028 5g In stock Chongqing Inquiry
  • Product code: SSC-200822
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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: 25g, 100g, 500g, 1000g
  • Available purity: >98%
  • Inventory rows with stock: 4
  • 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 89-98-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g >98% 5 In Stock Shanghai Inquiry
100g >98% 5 In Stock Beijing Inquiry
500g >98% 5 In Stock Shanghai Inquiry
1000g >98% 5 In Stock Shanghai Inquiry

89-98-5 / 2-chlorobenzaldehyde

Standard CAS: 89-98-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
89-98-5
Multi CAS
Yes
Molecular Formula
C7H5CLO
Molecular Weight
140.560000
Exact Mass
140.002893
InChI
InChI=1S/C7H5ClO/c8-7-4-2-1-3-6(7)5-9/h1-5H
InChIKey
FPYUJUBAXZAQNL-UHFFFAOYSA-N

Physical Properties

Melting Point
54.3 °F (NTP, 1992) 11.9 °C 12.4 °C
Boiling Point
413.4 °F at 760 mmHg (NTP, 1992) 212 °C 211.9 °C
Density
1.248 at 68 °F (NTP, 1992) - Denser than water; will sink 1.2483 g/cu cm at 20 °C BP range: 209-214 °C; density: 1.240-1.245 at 25 °C/25 °C. Soluble in alcohol, ether, acetone; insoluble in water /Chlorobenzaldehyde/ 1.25 g/cm³
Physical Description
2-chlorobenzaldehyde is a clear colorless to yellowish liquid. (NTP, 1992) Liquid Colorless to yellow liquid; mp = 12.4 deg C; [ICSC] COLOURLESS-TO-YELLOW LIQUID WITH PUNGENT ODOUR.
Appearance
Colorless to yellowish liquid Needles Liquid or needles
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
36.84
TPSA
17.07

LogP / Solubility

WLOGP
2.15
MLOGP
1.89
XLogP3
2.3
Consensus LogP
2.11
Log S (ESOL)
-2.49
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.27
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.48
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)
-2.05

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

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