Home Amines 10203-89-1
10203-89-1,MFCD19217154
Catalog No.:AA0006C0
10203-89-1 | 1-Pentanol, 4-methyl-2-(methylamino)-, (2S)-
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Technical Information
Catalog Number:
AA0006C0
Chemical Name:
1-Pentanol, 4-methyl-2-(methylamino)-, (2S)-
CAS Number:
10203-89-1
Molecular Formula:
C7H17NO
Molecular Weight:
131.2160
MDL Number:
MFCD19217154
IUPAC Name:
(2S)-4-methyl-2-(methylamino)pentan-1-ol
InChI:
InChI=1S/C7H17NO/c1-6(2)4-7(5-9)8-3/h6-9H,4-5H2,1-3H3/t7-/m0/s1
InChI Key:
LUAXDSKCXOZUGI-ZETCQYMHSA-N
SMILES:
CN[C@@H](CC(C)C)CO
Properties
Computed Properties
 
Complexity:
63.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
131.131g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
131.219g/mol
Monoisotopic Mass:
131.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Synonyms
 
10203-89-1 
N-methyl leucinol 
1-Pentanol, 4-methyl-2-(methylamino)-, (2S)- 
SCHEMBL4112036 
CTK0D9273 
DTXSID90507174 
ZINC38121305 
AKOS006349736 
(2S)-2-(Methylamino)-4-methyl-1-pentanol 
(2S)-4-Methyl-2-(methylamino)pentan-1-ol 
1-Pentanol, 4-methyl-2-(methylamino)-, (S)- 
Literature
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