2-Pyrrolidinemethanol, 1-(phenylmethyl)-, (2S)-


Chemical Name: 2-Pyrrolidinemethanol, 1-(phenylmethyl)-, (2S)-
CAS Number: 53912-80-4
Product Number: AG003BF5(AGN-PC-0OBZ8U)
Synonyms:
MDL No:
Molecular Formula: C12H17NO
Molecular Weight: 191.2695

Identification/Properties


Properties
MP:
110°C
BP:
313.3°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
n20/D 1.541(lit.)
Computed Properties
Molecular Weight:
191.274g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
191.131g/mol
Monoisotopic Mass:
191.131g/mol
Topological Polar Surface Area:
23.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
166
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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