Home Carboxys 2-phenyloxolane-2-carboxylic acid

2-phenyloxolane-2-carboxylic acid

CAS No.:
19679-84-6
Catalog Number:
AG01C7BW
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01C7BW
Chemical Name:
2-phenyloxolane-2-carboxylic acid
CAS Number:
19679-84-6
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD20656728
IUPAC Name:
2-phenyloxolane-2-carboxylic acid
InChI:
InChI=1S/C11H12O3/c12-10(13)11(7-4-8-14-11)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,13)
InChI Key:
XYCFRUQFTPLHSD-UHFFFAOYSA-N
SMILES:
O=C(C1CCCO1)Oc1ccccc1
Properties
Complexity:
221  
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:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties