2-Pyrrolidinone, 1-(4-aminophenyl)-


Chemical Name: 2-Pyrrolidinone, 1-(4-aminophenyl)-
CAS Number: 13691-22-0
Product Number: AG0012JU(AGN-PC-0JUSI5)
Synonyms:
MDL No: MFCD00100993
Molecular Formula: C10H12N2O
Molecular Weight: 176.2151

Identification/Properties


Properties
MP:
122-123℃
BP:
462.2 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
176.219g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
176.095g/mol
Monoisotopic Mass:
176.095g/mol
Topological Polar Surface Area:
46.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
197
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The chemical structure of 2-Pyrrolidinone, 1-(4-aminophenyl)- (C10H12N2O) is as follows: ``` H H | | H-N-C-C(=O) | | H-C-C-NH2 | | H H ``` This structure represents a pyrrolidinone ring with a 4-aminophenyl substituent attached to the nitrogen atom at position 1.