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848307-24-4 | ((3R,4S)-4-Phenylpyrrolidin-3-yl)methanol
CAS No: 848307-24-4 Catalog No: AG004X2Y MDL No:
Product Description
Catalog Number:
AG004X2Y
Chemical Name:
((3R,4S)-4-Phenylpyrrolidin-3-yl)methanol
CAS Number:
848307-24-4
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
[(3R,4S)-4-phenylpyrrolidin-3-yl]methanol
InChI:
InChI=1S/C11H15NO/c13-8-10-6-12-7-11(10)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2/t10-,11-/m1/s1
InChI Key:
MMDOXIYRYUVGPQ-GHMZBOCLSA-N
SMILES:
OC[C@H]1CNC[C@@H]1c1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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