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1245646-52-9 | Morpholine, 4-[1-(phenylmethyl)-3-pyrrolidinyl]-
CAS No: 1245646-52-9 Catalog No: AG000MBB MDL No:MFCD16659837
Product Description
Catalog Number:
AG000MBB
Chemical Name:
Morpholine, 4-[1-(phenylmethyl)-3-pyrrolidinyl]-
CAS Number:
1245646-52-9
Molecular Formula:
C15H22N2O
Molecular Weight:
246.3480
MDL Number:
MFCD16659837
IUPAC Name:
4-(1-benzylpyrrolidin-3-yl)morpholine
InChI:
InChI=1S/C15H22N2O/c1-2-4-14(5-3-1)12-16-7-6-15(13-16)17-8-10-18-11-9-17/h1-5,15H,6-13H2
InChI Key:
RWCVUCABYYOWJT-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)C1CCN(C1)Cc1ccccc1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.354g/mol
Monoisotopic Mass:
246.173g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
15.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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