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1363380-59-9 | (3R,4R)-rel-4-Aminotetrahydro-2H-pyran-3-ol
CAS No: 1363380-59-9 Catalog No: AG0011NR MDL No:MFCD22417049
Product Description
Catalog Number:
AG0011NR
Chemical Name:
(3R,4R)-rel-4-Aminotetrahydro-2H-pyran-3-ol
CAS Number:
1363380-59-9
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
MDL Number:
MFCD22417049
IUPAC Name:
(3R,4R)-4-aminooxan-3-ol
InChI:
InChI=1S/C5H11NO2/c6-4-1-2-8-3-5(4)7/h4-5,7H,1-3,6H2/t4-,5+/m1/s1
InChI Key:
PBQHDTRHGNGTLZ-UHNVWZDZSA-N
SMILES:
N[C@@H]1CCOC[C@@H]1O
Properties
Complexity:
76.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
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