Home Aminos (2S)-1-aminobutan-2-ol

(2S)-1-aminobutan-2-ol

CAS No.:
30608-63-0
Catalog Number:
AG01B9B5
Molecular Formula:
C4H11NO
Molecular Weight:
89.1362
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Product Description
Catalog Number:
AG01B9B5
Chemical Name:
(2S)-1-aminobutan-2-ol
CAS Number:
30608-63-0
Molecular Formula:
C4H11NO
Molecular Weight:
89.1362
MDL Number:
MFCD00079691
IUPAC Name:
1-aminobutan-2-ol
InChI:
InChI=1S/C4H11NO/c1-2-4(6)3-5/h4,6H,2-3,5H2,1H3
InChI Key:
KODLUXHSIZOKTG-UHFFFAOYSA-N
SMILES:
CC[C@@H](CN)O
NSC Number:
17695
UN Number:
2735
Properties
Complexity:
30.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
89.084g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
89.138g/mol
Monoisotopic Mass:
89.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Literature
Title Journal
Bis[eth-yl(2-hydroxy-ethyl)aza-nium] 2,2'-disulfanediyldibenzoate. Acta crystallographica. Section E, Structure reports online 20100301
Properties