Home Carbonyls 5-Phenylisoxazole-3-carbonyl chloride

5-Phenylisoxazole-3-carbonyl chloride

CAS No.:
78189-50-1
Catalog Number:
AG0054PF
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
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Product Description
Catalog Number:
AG0054PF
Chemical Name:
5-Phenylisoxazole-3-carbonyl chloride
CAS Number:
78189-50-1
Molecular Formula:
C10H6ClNO2
Molecular Weight:
207.6131
MDL Number:
MFCD07772806
IUPAC Name:
5-phenyl-1,2-oxazole-3-carbonyl chloride
InChI:
InChI=1S/C10H6ClNO2/c11-10(13)8-6-9(14-12-8)7-4-2-1-3-5-7/h1-6H
InChI Key:
FUQOIZJIDZZDGY-UHFFFAOYSA-N
SMILES:
ClC(=O)c1noc(c1)c1ccccc1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.009g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.613g/mol
Monoisotopic Mass:
207.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties