Home Other Building Blocks 3-methyl-3-[4-(propan-2-yl)phenyl]pyrrolidine-2,5-dione

3-methyl-3-[4-(propan-2-yl)phenyl]pyrrolidine-2,5-dione

CAS No.:
1094289-46-9
Catalog Number:
AG01ALRL
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
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Product Description
Catalog Number:
AG01ALRL
Chemical Name:
3-methyl-3-[4-(propan-2-yl)phenyl]pyrrolidine-2,5-dione
CAS Number:
1094289-46-9
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD11207828
IUPAC Name:
3-methyl-3-(4-propan-2-ylphenyl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C14H17NO2/c1-9(2)10-4-6-11(7-5-10)14(3)8-12(16)15-13(14)17/h4-7,9H,8H2,1-3H3,(H,15,16,17)
InChI Key:
QYDFHSLIPPLNND-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C1(C)CC(=O)NC1=O)C
Properties
Complexity:
329  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.126g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.295g/mol
Monoisotopic Mass:
231.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties