Home Other Building Blocks 4-Methoxy-3(2H)-benzofuranone

4-Methoxy-3(2H)-benzofuranone

CAS No.:
7169-35-9
Catalog Number:
AG005QPN
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
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Product Description
Catalog Number:
AG005QPN
Chemical Name:
4-Methoxy-3(2H)-benzofuranone
CAS Number:
7169-35-9
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD12828273
IUPAC Name:
4-methoxy-1-benzofuran-3-one
InChI:
InChI=1S/C9H8O3/c1-11-7-3-2-4-8-9(7)6(10)5-12-8/h2-4H,5H2,1H3
InChI Key:
IVSCFNOAUOCHJV-UHFFFAOYSA-N
SMILES:
COc1cccc2c1C(=O)CO2
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties