Home Other Building Blocks (3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol

(3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol

CAS No.:
1841379-64-3
Catalog Number:
AG01DZ48
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
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Product Description
Catalog Number:
AG01DZ48
Chemical Name:
(3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol
CAS Number:
1841379-64-3
Molecular Formula:
C6H13NO2
Molecular Weight:
131.1729
IUPAC Name:
(3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol
InChI:
InChI=1S/C6H13NO2/c1-7-3-6(9)2-5(7)4-8/h5-6,8-9H,2-4H2,1H3/t5-,6-/m0/s1
InChI Key:
IXFHJDFJPFHQLP-WDSKDSINSA-N
SMILES:
OC[C@@H]1C[C@@H](CN1C)O
Properties
Complexity:
97.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
131.095g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
131.175g/mol
Monoisotopic Mass:
131.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties