1-Piperazinecarboxylic acid, 3-(hydroxymethyl)-, phenylmethyl ester


Chemical Name: 1-Piperazinecarboxylic acid, 3-(hydroxymethyl)-, phenylmethyl ester
CAS Number: 191739-40-9
Product Number: AG002FG6(AGN-PC-0KKLQ8)
Synonyms:
MDL No:
Molecular Formula: C13H18N2O3
Molecular Weight: 250.2936

Identification/Properties


Computed Properties
Molecular Weight:
250.298g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
250.132g/mol
Monoisotopic Mass:
250.132g/mol
Topological Polar Surface Area:
61.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
267
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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