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1446001-76-8 | Methanone, [(3R)-3-hydroxy-1-pyrrolidinyl](tetrahydro-2H-pyran-4-yl)-
CAS No: 1446001-76-8 Catalog No: AG001JT6 MDL No:
Product Description
Catalog Number:
AG001JT6
Chemical Name:
Methanone, [(3R)-3-hydroxy-1-pyrrolidinyl](tetrahydro-2H-pyran-4-yl)-
CAS Number:
1446001-76-8
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
IUPAC Name:
[(3R)-3-hydroxypyrrolidin-1-yl]-(oxan-4-yl)methanone
InChI:
InChI=1S/C10H17NO3/c12-9-1-4-11(7-9)10(13)8-2-5-14-6-3-8/h8-9,12H,1-7H2/t9-/m1/s1
InChI Key:
QLYXQTUXFAMVAL-SECBINFHSA-N
SMILES:
O[C@@H]1CCN(C1)C(=O)C1CCOCC1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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