Home Aminos D-Mannitol, 1-amino-2,5-anhydro-1-deoxy-

D-Mannitol, 1-amino-2,5-anhydro-1-deoxy-

CAS No.:
228862-97-3
Catalog Number:
AG002LCW
Molecular Formula:
C6H13NO4
Molecular Weight:
163.1717
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Product Description
Catalog Number:
AG002LCW
Chemical Name:
D-Mannitol, 1-amino-2,5-anhydro-1-deoxy-
CAS Number:
228862-97-3
Molecular Formula:
C6H13NO4
Molecular Weight:
163.1717
MDL Number:
MFCD01863332
IUPAC Name:
(2R,3S,4S,5R)-2-(aminomethyl)-5-(hydroxymethyl)oxolane-3,4-diol
InChI:
InChI=1S/C6H13NO4/c7-1-3-5(9)6(10)4(2-8)11-3/h3-6,8-10H,1-2,7H2/t3-,4-,5-,6-/m1/s1
InChI Key:
IKPYGNYNWRCKKG-KVTDHHQDSA-N
SMILES:
NC[C@H]1O[C@@H]([C@H]([C@@H]1O)O)CO
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
163.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
163.173g/mol
Monoisotopic Mass:
163.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  
Properties