Home Other Building Blocks 2-(((4-Fluorobenzyl)Oxy)Methyl)-2,3-Dihydrobenzofuran-5-Carboxylic Acid

2-(((4-Fluorobenzyl)Oxy)Methyl)-2,3-Dihydrobenzofuran-5-Carboxylic Acid

CAS No.:
197506-40-4
Catalog Number:
AG01DJG9
Molecular Formula:
C17H15FO4
Molecular Weight:
302.2970
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Product Description
Catalog Number:
AG01DJG9
Chemical Name:
2-(((4-Fluorobenzyl)Oxy)Methyl)-2,3-Dihydrobenzofuran-5-Carboxylic Acid
CAS Number:
197506-40-4
Molecular Formula:
C17H15FO4
Molecular Weight:
302.2970
MDL Number:
MFCD30472156
IUPAC Name:
2-[(4-fluorophenyl)methoxymethyl]-2,3-dihydro-1-benzofuran-5-carboxylic acid
InChI:
InChI=1S/C17H15FO4/c18-14-4-1-11(2-5-14)9-21-10-15-8-13-7-12(17(19)20)3-6-16(13)22-15/h1-7,15H,8-10H2,(H,19,20)
InChI Key:
LHECRXMDTSKTDZ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)COCC1Oc2c(C1)cc(cc2)C(=O)O
Properties
Complexity:
381  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.095g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
302.301g/mol
Monoisotopic Mass:
302.095g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties