Home Other Building Blocks 2-(pyrrolidin-1-yl)propane-1,3-diol

2-(pyrrolidin-1-yl)propane-1,3-diol

CAS No.:
78531-50-7
Catalog Number:
AG01DWO4
Molecular Formula:
C7H15NO2
Molecular Weight:
145.1995
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Product Description
Catalog Number:
AG01DWO4
Chemical Name:
2-(pyrrolidin-1-yl)propane-1,3-diol
CAS Number:
78531-50-7
Molecular Formula:
C7H15NO2
Molecular Weight:
145.1995
MDL Number:
MFCD20529581
IUPAC Name:
2-pyrrolidin-1-ylpropane-1,3-diol
InChI:
InChI=1S/C7H15NO2/c9-5-7(6-10)8-3-1-2-4-8/h7,9-10H,1-6H2
InChI Key:
DFFIMWGZWCJZEK-UHFFFAOYSA-N
SMILES:
OCC(N1CCCC1)CO
Properties
Complexity:
87.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.11g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
145.202g/mol
Monoisotopic Mass:
145.11g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties