Home Carboxys 2-[(4-fluorophenyl)methyl]oxolane-2-carboxylic acid

2-[(4-fluorophenyl)methyl]oxolane-2-carboxylic acid

CAS No.:
2024359-30-4
Catalog Number:
AG01DW5B
Molecular Formula:
C12H13FO3
Molecular Weight:
224.2282
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DW5B
Chemical Name:
2-[(4-fluorophenyl)methyl]oxolane-2-carboxylic acid
CAS Number:
2024359-30-4
Molecular Formula:
C12H13FO3
Molecular Weight:
224.2282
MDL Number:
MFCD31666370
IUPAC Name:
2-[(4-fluorophenyl)methyl]oxolane-2-carboxylic acid
InChI:
InChI=1S/C12H13FO3/c13-10-4-2-9(3-5-10)8-12(11(14)15)6-1-7-16-12/h2-5H,1,6-8H2,(H,14,15)
InChI Key:
ZBTBLCIDBRXSDZ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)CC1(CCCO1)C(=O)O
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.231g/mol
Monoisotopic Mass:
224.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties