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2-cyclobutoxybenzoic acid

CAS No.:
1275723-72-2
Catalog Number:
AG01AJHU
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01AJHU
Chemical Name:
2-cyclobutoxybenzoic acid
CAS Number:
1275723-72-2
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD16692375
IUPAC Name:
2-cyclobutyloxybenzoic acid
InChI:
InChI=1S/C11H12O3/c12-11(13)9-6-1-2-7-10(9)14-8-4-3-5-8/h1-2,6-8H,3-5H2,(H,12,13)
InChI Key:
XCFXPZJDGPQGFL-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1OC1CCC1
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties