Home Other Building Blocks 3-(2-methoxy-2-oxoethoxy)benzoic acid

3-(2-methoxy-2-oxoethoxy)benzoic acid

CAS No.:
113496-13-2
Catalog Number:
AG019WB2
Molecular Formula:
C10H10O5
Molecular Weight:
210.1834
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Product Description
Catalog Number:
AG019WB2
Chemical Name:
3-(2-methoxy-2-oxoethoxy)benzoic acid
CAS Number:
113496-13-2
Molecular Formula:
C10H10O5
Molecular Weight:
210.1834
MDL Number:
MFCD09943982
IUPAC Name:
3-(2-methoxy-2-oxoethoxy)benzoic acid
InChI:
InChI=1S/C10H10O5/c1-14-9(11)6-15-8-4-2-3-7(5-8)10(12)13/h2-5H,6H2,1H3,(H,12,13)
InChI Key:
HWVYHIGFOQWPMJ-UHFFFAOYSA-N
SMILES:
COC(=O)COc1cccc(c1)C(=O)O
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.185g/mol
Monoisotopic Mass:
210.053g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties