Home Carboxys 5-Methoxybenzo[b]furan-3-carboxylic acid

5-Methoxybenzo[b]furan-3-carboxylic acid

CAS No.:
23455-49-4
Catalog Number:
AG00BHMR
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
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Product Description
Catalog Number:
AG00BHMR
Chemical Name:
5-Methoxybenzo[b]furan-3-carboxylic acid
CAS Number:
23455-49-4
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD06643856
IUPAC Name:
5-methoxy-1-benzofuran-3-carboxylic acid
InChI:
InChI=1S/C10H8O4/c1-13-6-2-3-9-7(4-6)8(5-14-9)10(11)12/h2-5H,1H3,(H,11,12)
InChI Key:
YQUJKKPVLBKITF-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(co2)C(=O)O
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties