1(2H)-Pyridinecarboxylic acid, 3,4-dihydro-, phenylmethyl ester


Chemical Name: 1(2H)-Pyridinecarboxylic acid, 3,4-dihydro-, phenylmethyl ester
CAS Number: 68471-58-9
Product Number: AG006JNT(AGN-PC-00Q16W)
Synonyms:
MDL No:
Molecular Formula: C13H15NO2
Molecular Weight: 217.2637

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Form:
Liquid
Refractive Index:
n20/D1.552
Computed Properties
Molecular Weight:
217.268g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
217.11g/mol
Monoisotopic Mass:
217.11g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
257
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#:
2810
Hazard Statements:
H301
Precautionary Statements:
P301+P310
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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