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

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

CAS No.:
926187-55-5
Catalog Number:
AG01A8EV
Molecular Formula:
C14H18O2
Molecular Weight:
218.2915
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Product Description
Catalog Number:
AG01A8EV
Chemical Name:
1-[4-(propan-2-yl)phenyl]cyclobutane-1-carboxylic acid
CAS Number:
926187-55-5
Molecular Formula:
C14H18O2
Molecular Weight:
218.2915
MDL Number:
MFCD08442883
IUPAC Name:
1-(4-propan-2-ylphenyl)cyclobutane-1-carboxylic acid
InChI:
InChI=1S/C14H18O2/c1-10(2)11-4-6-12(7-5-11)14(13(15)16)8-3-9-14/h4-7,10H,3,8-9H2,1-2H3,(H,15,16)
InChI Key:
JAHNYTPOYIGJRH-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C1(CCC1)C(=O)O)C
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.131g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.296g/mol
Monoisotopic Mass:
218.131g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties