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1408229-31-1 | 2-Pentanol, 3-amino-2-methyl-5-(methylthio)-, hydrochloride (1:1), (3R)-
CAS No: 1408229-31-1 Catalog No: AG001CV3 MDL No:
Product Description
Catalog Number:
AG001CV3
Chemical Name:
2-Pentanol, 3-amino-2-methyl-5-(methylthio)-, hydrochloride (1:1), (3R)-
CAS Number:
1408229-31-1
IUPAC Name:
(3R)-3-amino-2-methyl-5-methylsulfanylpentan-2-ol;hydrochloride
InChI:
InChI=1S/C7H17NOS.ClH/c1-7(2,9)6(8)4-5-10-3;/h6,9H,4-5,8H2,1-3H3;1H/t6-;/m1./s1
InChI Key:
KBXVETFSOHYWIP-FYZOBXCZSA-N
Properties
Complexity:
95.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
199.08g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
199.737g/mol
Monoisotopic Mass:
199.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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