3,4-Pyrrolidinediol, 1-(phenylmethyl)-, (3S,4S)-


Chemical Name: 3,4-Pyrrolidinediol, 1-(phenylmethyl)-, (3S,4S)-
CAS Number: 90365-74-5
Product Number: AG003AYB(AGN-PC-0OMBCH)
Synonyms:
MDL No:
Molecular Formula: C11H15NO2
Molecular Weight: 193.2423

Identification/Properties


Properties
MP:
94-100 °C
BP:
356.2 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5041 (estimate)
Computed Properties
Molecular Weight:
193.246g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
193.11g/mol
Monoisotopic Mass:
193.11g/mol
Topological Polar Surface Area:
43.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
170
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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