1H-Pyrrole-3-carboxylic acid,2,5-dihydro-4-hydroxy-5-oxo-1-(phenylmethyl)-, ethyl ester


Chemical Name: 1H-Pyrrole-3-carboxylic acid,2,5-dihydro-4-hydroxy-5-oxo-1-(phenylmethyl)-, ethyl ester
CAS Number: 4450-98-0
Product Number: AG003E00(AGN-PC-0RSZ8N)
Synonyms:
MDL No:
Molecular Formula: C14H15NO4
Molecular Weight: 261.2732

Identification/Properties


Properties
MP:
132-134°C
BP:
408.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
261.277g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
261.1g/mol
Monoisotopic Mass:
261.1g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
396
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:
Danger
UN#:
1759
Hazard Statements:
H302-H318
Precautionary Statements:
P280-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback