Home Carboxys Methyl benzofuran-5-carboxylate

Methyl benzofuran-5-carboxylate

CAS No.:
108763-47-9
Catalog Number:
AG003RZF
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
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Product Description
Catalog Number:
AG003RZF
Chemical Name:
Methyl benzofuran-5-carboxylate
CAS Number:
108763-47-9
Molecular Formula:
C10H8O3
Molecular Weight:
176.1687
MDL Number:
MFCD06204199
IUPAC Name:
methyl 1-benzofuran-5-carboxylate
InChI:
InChI=1S/C10H8O3/c1-12-10(11)8-2-3-9-7(6-8)4-5-13-9/h2-6H,1H3
InChI Key:
XDRBAVJWSHNLQN-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)cco2
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.047g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.171g/mol
Monoisotopic Mass:
176.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties