Home Aminos 2-Pentanol, 3-amino-2,4-dimethyl-, (3S)-

2-Pentanol, 3-amino-2,4-dimethyl-, (3S)-

CAS No.:
163453-95-0
Catalog Number:
AG001U53
Molecular Formula:
C7H17NO
Molecular Weight:
131.2160
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Product Description
Catalog Number:
AG001U53
Chemical Name:
2-Pentanol, 3-amino-2,4-dimethyl-, (3S)-
CAS Number:
163453-95-0
Molecular Formula:
C7H17NO
Molecular Weight:
131.2160
MDL Number:
MFCD19203234
IUPAC Name:
(3S)-3-amino-2,4-dimethylpentan-2-ol
InChI:
InChI=1S/C7H17NO/c1-5(2)6(8)7(3,4)9/h5-6,9H,8H2,1-4H3/t6-/m0/s1
InChI Key:
HPSNEEWVFSIINY-LURJTMIESA-N
SMILES:
CC([C@@H](C(O)(C)C)N)C
Properties
Complexity:
88.9  
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:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
A new class of non-racemic chiral macrocycles: a conformational and synthetic study. Chemistry (Weinheim an der Bergstrasse, Germany) 20041217
Properties