Home Carboxys 1-[4-(2-methylpropoxy)phenyl]cyclobutane-1-carboxylic acid

1-[4-(2-methylpropoxy)phenyl]cyclobutane-1-carboxylic acid

CAS No.:
1037131-39-7
Catalog Number:
AG01AH49
Molecular Formula:
C15H20O3
Molecular Weight:
248.3175
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Product Description
Catalog Number:
AG01AH49
Chemical Name:
1-[4-(2-methylpropoxy)phenyl]cyclobutane-1-carboxylic acid
CAS Number:
1037131-39-7
Molecular Formula:
C15H20O3
Molecular Weight:
248.3175
MDL Number:
MFCD11541476
IUPAC Name:
1-[4-(2-methylpropoxy)phenyl]cyclobutane-1-carboxylic acid
InChI:
InChI=1S/C15H20O3/c1-11(2)10-18-13-6-4-12(5-7-13)15(14(16)17)8-3-9-15/h4-7,11H,3,8-10H2,1-2H3,(H,16,17)
InChI Key:
DCJXHNFATQSUPH-UHFFFAOYSA-N
SMILES:
CC(COc1ccc(cc1)C1(CCC1)C(=O)O)C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.141g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.322g/mol
Monoisotopic Mass:
248.141g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties