Home Other Building Blocks 4-methoxy-2-[2-(propan-2-yloxy)ethoxy]benzoic acid

4-methoxy-2-[2-(propan-2-yloxy)ethoxy]benzoic acid

CAS No.:
1285204-24-1
Catalog Number:
AG01BCVW
Molecular Formula:
C13H18O5
Molecular Weight:
254.2790
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Product Description
Catalog Number:
AG01BCVW
Chemical Name:
4-methoxy-2-[2-(propan-2-yloxy)ethoxy]benzoic acid
CAS Number:
1285204-24-1
Molecular Formula:
C13H18O5
Molecular Weight:
254.2790
MDL Number:
MFCD13200457
IUPAC Name:
4-methoxy-2-(2-propan-2-yloxyethoxy)benzoic acid
InChI:
InChI=1S/C13H18O5/c1-9(2)17-6-7-18-12-8-10(16-3)4-5-11(12)13(14)15/h4-5,8-9H,6-7H2,1-3H3,(H,14,15)
InChI Key:
OVLSTOXVRZLEGH-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OCCOC(C)C)C(=O)O
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.115g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.282g/mol
Monoisotopic Mass:
254.115g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties