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88958-33-2 | 5-(Furan-2-yl);isoxazole-3-carbonyl chloride
CAS No: 88958-33-2 Catalog No: AG0046JV MDL No:
Product Description
Catalog Number:
AG0046JV
Chemical Name:
5-(Furan-2-yl);isoxazole-3-carbonyl chloride
CAS Number:
88958-33-2
Molecular Formula:
C8H4ClNO3
Molecular Weight:
197.5753
IUPAC Name:
5-(furan-2-yl)-1,2-oxazole-3-carbonyl chloride
InChI:
InChI=1S/C8H4ClNO3/c9-8(11)5-4-7(13-10-5)6-2-1-3-12-6/h1-4H
InChI Key:
RCDNHOYZXMTBMF-UHFFFAOYSA-N
SMILES:
ClC(=O)c1noc(c1)c1ccco1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.988g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.574g/mol
Monoisotopic Mass:
196.988g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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