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10242-08-7

10242-08-7 | 2-Benzofurancarboxylic acid, 5-methoxy-

CAS No: 10242-08-7 Catalog No: AG0007FI MDL No:MFCD00079771

Product Description

Catalog Number:
AG0007FI
Chemical Name:
2-Benzofurancarboxylic acid, 5-methoxy-
CAS Number:
10242-08-7
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD00079771
IUPAC Name:
5-methoxy-1-benzofuran-2-carboxylic acid
InChI:
InChI=1S/C10H8O4/c1-13-7-2-3-8-6(4-7)5-9(14-8)10(11)12/h2-5H,1H3,(H,11,12)
InChI Key:
XZELWEMGWISCTP-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)cc(o2)C(=O)O
NSC Number:
149912

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:
2.4  

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