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26004-82-0 | 2,5-Pyrrolidinedione, 1-(2,2-dimethyl-1-oxopropyl)-
CAS No: 26004-82-0 Catalog No: AG002RD5 MDL No:
Product Description
Catalog Number:
AG002RD5
Chemical Name:
2,5-Pyrrolidinedione, 1-(2,2-dimethyl-1-oxopropyl)-
CAS Number:
26004-82-0
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
IUPAC Name:
1-(2,2-dimethylpropanoyl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C9H13NO3/c1-9(2,3)8(13)10-6(11)4-5-7(10)12/h4-5H2,1-3H3
InChI Key:
AWBFRXMPSWDKTR-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)N1C(=O)CCC1=O
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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