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144525-90-6

144525-90-6 | 2,3-Pyrrolidinedione, 4-[(4-hydroxyphenyl)methylene]-1-methyl-

CAS No: 144525-90-6 Catalog No: AG001JPF MDL No:

Product Description

Catalog Number:
AG001JPF
Chemical Name:
2,3-Pyrrolidinedione, 4-[(4-hydroxyphenyl)methylene]-1-methyl-
CAS Number:
144525-90-6
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
IUPAC Name:
4-[(4-hydroxyphenyl)methylidene]-1-methylpyrrolidine-2,3-dione
InChI:
InChI=1S/C12H11NO3/c1-13-7-9(11(15)12(13)16)6-8-2-4-10(14)5-3-8/h2-6,14H,7H2,1H3
InChI Key:
QQJGFTRMRAYQOG-UHFFFAOYSA-N
SMILES:
CN1CC(=Cc2ccc(cc2)O)C(=O)C1=O

Properties

Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.074g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.224g/mol
Monoisotopic Mass:
217.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.9  

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