200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 113655-56-4
113655-56-4 | 2-Benzofuranpentanoic acid, 4-hydroxy-, methyl ester
CAS No: 113655-56-4 Catalog No: AG000987 MDL No:
Product Description
Catalog Number:
AG000987
Chemical Name:
2-Benzofuranpentanoic acid, 4-hydroxy-, methyl ester
CAS Number:
113655-56-4
Molecular Formula:
C14H16O4
Molecular Weight:
248.2744
IUPAC Name:
methyl 5-(4-hydroxy-2-benzofuran-1-yl)pentanoate
InChI:
InChI=1S/C14H16O4/c1-17-14(16)8-3-2-7-13-10-5-4-6-12(15)11(10)9-18-13/h4-6,9,15H,2-3,7-8H2,1H3
InChI Key:
KFPDLLPLEWVDSO-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCc1occ2c1cccc2O
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.278g/mol
Monoisotopic Mass:
248.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.