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121663-74-9 | 1H-Pyrrole-2,5-dione, 1-(6-aminohexyl)-
CAS No: 121663-74-9 Catalog No: AG0015JJ MDL No:
Product Description
Catalog Number:
AG0015JJ
Chemical Name:
1H-Pyrrole-2,5-dione, 1-(6-aminohexyl)-
CAS Number:
121663-74-9
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
IUPAC Name:
1-(6-aminohexyl)pyrrole-2,5-dione
InChI:
InChI=1S/C10H16N2O2/c11-7-3-1-2-4-8-12-9(13)5-6-10(12)14/h5-6H,1-4,7-8,11H2
InChI Key:
HNWOYAYJUYWRGD-UHFFFAOYSA-N
SMILES:
NCCCCCCN1C(=O)C=CC1=O
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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