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545424-40-6

545424-40-6 | 4-(Isoxazol-3-yl)benzaldehyde

CAS No: 545424-40-6 Catalog No: AG01EDSE MDL No:

Product Description

Catalog Number:
AG01EDSE
Chemical Name:
4-(Isoxazol-3-yl)benzaldehyde
CAS Number:
545424-40-6
IUPAC Name:
4-(1,2-oxazol-3-yl)benzaldehyde
InChI:
InChI=1S/C10H7NO2/c12-7-8-1-3-9(4-2-8)10-5-6-13-11-10/h1-7H
InChI Key:
CKXIBRZSSSCIJS-UHFFFAOYSA-N

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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