200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 141034-37-9
141034-37-9 | 1(3H)-Isobenzofuranone, 3-(2-hydroxy-5-methylphenyl)-3-phenyl-
CAS No: 141034-37-9 Catalog No: AG001FRN MDL No:
Product Description
Catalog Number:
AG001FRN
Chemical Name:
1(3H)-Isobenzofuranone, 3-(2-hydroxy-5-methylphenyl)-3-phenyl-
CAS Number:
141034-37-9
Molecular Formula:
C21H16O3
Molecular Weight:
316.3499
IUPAC Name:
3-(2-hydroxy-5-methylphenyl)-3-phenyl-2-benzofuran-1-one
InChI:
InChI=1S/C21H16O3/c1-14-11-12-19(22)18(13-14)21(15-7-3-2-4-8-15)17-10-6-5-9-16(17)20(23)24-21/h2-13,22H,1H3
InChI Key:
NCTBREQICUGUQW-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C1(OC(=O)c2c1cccc2)c1ccccc1)O
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.11g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.356g/mol
Monoisotopic Mass:
316.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.