390119
2-Chloro-3-quinolinecarboxaldehyde
98%
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About This Item
Empirical Formula (Hill Notation):
C10H6ClNO
CAS Number:
Molecular Weight:
191.61
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Product Name
2-Chloro-3-quinolinecarboxaldehyde, 98%
InChI
1S/C10H6ClNO/c11-10-8(6-13)5-7-3-1-2-4-9(7)12-10/h1-6H
SMILES string
Clc1nc2ccccc2cc1C=O
InChI key
SDKQWXCBSNMYBN-UHFFFAOYSA-N
assay
98%
mp
148-150 °C (lit.)
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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M V S Prasad et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 148, 163-174 (2015-04-17)
In the present study, the FT-IR and FT-Raman spectra of 2-chloro-3-quinolinecarboxaldehyde (2Cl3QC) have been recorded in the region 4000-400 and 3500-50 cm(-1), respectively. The fundamental modes of vibrational frequencies of 2Cl3QC are assigned. Theoretical information on the optimized geometry, harmonic
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