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73217-76-2

73217-76-2 | 3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOLE-5-CARBALDEHYDE

CAS No: 73217-76-2 Catalog No: AG005Q0H MDL No:MFCD08059880

Product Description

Catalog Number:
AG005Q0H
Chemical Name:
3-(4-CHLOROPHENYL)-1,2,4-OXADIAZOLE-5-CARBALDEHYDE
CAS Number:
73217-76-2
Molecular Formula:
C9H5ClN2O2
Molecular Weight:
208.6012
MDL Number:
MFCD08059880
IUPAC Name:
3-(4-chlorophenyl)-1,2,4-oxadiazole-5-carbaldehyde
InChI:
InChI=1S/C9H5ClN2O2/c10-7-3-1-6(2-4-7)9-11-8(5-13)14-12-9/h1-5H
InChI Key:
REMKDKLUCMAKDU-UHFFFAOYSA-N
SMILES:
O=Cc1onc(n1)c1ccc(cc1)Cl

Properties

Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.004g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.601g/mol
Monoisotopic Mass:
208.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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