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819066-95-0

819066-95-0 | 2-(4-(3,5-bis(hydroxymethyl)phenoxy)butyl)isoindoline-1,3-dione

CAS No: 819066-95-0 Catalog No: AG00GADH MDL No:

Product Description

Catalog Number:
AG00GADH
Chemical Name:
2-(4-(3,5-bis(hydroxymethyl)phenoxy)butyl)isoindoline-1,3-dione
CAS Number:
819066-95-0
IUPAC Name:
2-[4-[3,5-bis(hydroxymethyl)phenoxy]butyl]isoindole-1,3-dione
InChI:
InChI=1S/C20H21NO5/c22-12-14-9-15(13-23)11-16(10-14)26-8-4-3-7-21-19(24)17-5-1-2-6-18(17)20(21)25/h1-2,5-6,9-11,22-23H,3-4,7-8,12-13H2
InChI Key:
IAFYCKVNSHCQQX-UHFFFAOYSA-N

Properties

Complexity:
461  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.142g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
355.39g/mol
Monoisotopic Mass:
355.142g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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