3-Thiophenecarboxylic acid, 2-amino-5-phenyl-, methyl ester


Chemical Name: 3-Thiophenecarboxylic acid, 2-amino-5-phenyl-, methyl ester
CAS Number: 61325-02-8
Product Number: AG00EE1U(AGN-PC-0JV74F)
Synonyms:
MDL No:
Molecular Formula: C12H11NO2S
Molecular Weight: 233.2862

Identification/Properties


Computed Properties
Molecular Weight:
233.285g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
233.051g/mol
Monoisotopic Mass:
233.051g/mol
Topological Polar Surface Area:
80.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
253
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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