Home Amines 111821-58-0
111821-58-0,MFCD00078584
Catalog No.:AA008SD2
111821-58-0 | (S)-(-)-3-AMINO-1-HYDROXYPYRROLIDIN-2-ONE
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Technical Information
Catalog Number:
AA008SD2
Chemical Name:
(S)-(-)-3-AMINO-1-HYDROXYPYRROLIDIN-2-ONE
CAS Number:
111821-58-0
Molecular Formula:
C4H8N2O2
Molecular Weight:
116.1185
MDL Number:
MFCD00078584
IUPAC Name:
(3S)-3-amino-1-hydroxypyrrolidin-2-one
InChI:
InChI=1S/C4H8N2O2/c5-3-1-2-6(8)4(3)7/h3,8H,1-2,5H2/t3-/m0/s1
InChI Key:
HCKUBNLZMKAEIN-VKHMYHEASA-N
SMILES:
O=C1[C@@H](N)CCN1O
UNII:
3C1G86U80C
Properties
Computed Properties
 
Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
116.059g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
116.12g/mol
Monoisotopic Mass:
116.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  

Synonyms
 
(S)-(-)-HA-966 
111821-58-0 
(-)-HA 966 
2-Pyrrolidinone, 3-amino-1-hydroxy-, (S)- 
Biomol-NT_000204 
BPBio1_001260 
SCHEMBL8336407 
CHEMBL1564377 
HMS3266E17 
HMS3675C21 
ZINC3870324 
BN0246 
UNII-3C1G86U80C 
FCH839176 
AKOS024457304 
(S)-3-amino-1-hydroxypyrrolidin-2-one 
NCGC00024523-01 
NCGC00024523-02 
AJ-46332 
(-)-HA-966 
2-Pyrrolidinone,3-amino-1-hydroxy-,(3S)- 
B6244 
FT-0645237 
(S)-(-)-3-Amino-1-hydroxypyrrolidin-2-one 
2-Pyrrolidinone, 3-amino-1-hydroxy-, (3S)- 
C-56143 
SR-01000597726 
J-002639 
SR-01000597726-1 
I14-38812 
UNII-F2JLV9220T component HCKUBNLZMKAEIN-VKHMYHEASA-N 
A126_SIGMA 
CID183351 
3C1G86U80C 
(S)-HA 966 
Tocris-0282 
HA-966, (S)- 
(3S)-3-amino-1-hydroxypyrrolidin-2-one 
AC1L4CQE 
Literature
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