2-Methyl-2-phthalimidyl-3-(3?-benzoxyphenyl)propionic Acid Methyl Ester - CAS 1076198-56-5

Catalog:	BB076061
Product Name:	2-Methyl-2-phthalimidyl-3-(3?-benzoxyphenyl)propionic Acid Methyl Ester
CAS:	1076198-56-5
Synonyms:	2-Methyl-2-phthalimidyl-3-(3'-benzoxyphenyl)propionic Acid Methyl Ester; methyl 2-(1,3-dioxoisoindol-2-yl)-2-methyl-3-(3-phenylmethoxyphenyl)propanoate; Methyl 3-[3-(benzyloxy)phenyl]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-methylpropanoate; 2-Methyl-2-phthalimidyl-3-(3 inverted exclamation mark -benzoxyphenyl)propionic Acid Methyl Ester

Technical Data

IUPAC Name:	methyl 2-(1,3-dioxoisoindol-2-yl)-2-methyl-3-(3-phenylmethoxyphenyl)propanoate
Molecular Weight:	429.46
Molecular Formula:	C26H23NO5
Canonical SMILES:	CC(CC1=CC(=CC=C1)OCC2=CC=CC=C2)(C(=O)OC)N3C(=O)C4=CC=CC=C4C3=O
InChI:	InChI=1S/C26H23NO5/c1-26(25(30)31-2,27-23(28)21-13-6-7-14-22(21)24(27)29)16-19-11-8-12-20(15-19)32-17-18-9-4-3-5-10-18/h3-15H,16-17H2,1-2H3
InChI Key:	FFVSOGRKDYQJKA-UHFFFAOYSA-N

Complexity:	678
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	429.15762283
Formal Charge:	0
Heavy Atom Count:	32
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	429.15762283
Rotatable Bond Count:	8
Topological Polar Surface Area:	72.9Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	4.5