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1353954-61-6

1353954-61-6 | 2-[3-(Benzyl-ethyl-amino)-pyrrolidin-1-yl]-ethanol

CAS No: 1353954-61-6 Catalog No: AG01F902 MDL No:

Product Description

Catalog Number:
AG01F902
Chemical Name:
2-[3-(Benzyl-ethyl-amino)-pyrrolidin-1-yl]-ethanol
CAS Number:
1353954-61-6
Molecular Formula:
C15H24N2O
Molecular Weight:
248.3639
IUPAC Name:
2-[3-[benzyl(ethyl)amino]pyrrolidin-1-yl]ethanol
InChI:
InChI=1S/C15H24N2O/c1-2-17(12-14-6-4-3-5-7-14)15-8-9-16(13-15)10-11-18/h3-7,15,18H,2,8-13H2,1H3
InChI Key:
VGMOOKQYMFPMTM-UHFFFAOYSA-N
SMILES:
OCCN1CCC(C1)N(Cc1ccccc1)CC

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.189g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.37g/mol
Monoisotopic Mass:
248.189g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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