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89597-98-8

89597-98-8 | Pyrrolidine, 2-[[(2,4,6-trimethylphenyl)methoxy]methyl]-, (S)-

CAS No: 89597-98-8 Catalog No: AG003YU2 MDL No:

Product Description

Catalog Number:
AG003YU2
Chemical Name:
Pyrrolidine, 2-[[(2,4,6-trimethylphenyl)methoxy]methyl]-, (S)-
CAS Number:
89597-98-8
Molecular Formula:
C15H23NO
Molecular Weight:
233.3492
IUPAC Name:
2-[(2,4,6-trimethylphenyl)methoxymethyl]pyrrolidine
InChI:
InChI=1S/C15H23NO/c1-11-7-12(2)15(13(3)8-11)10-17-9-14-5-4-6-16-14/h7-8,14,16H,4-6,9-10H2,1-3H3
InChI Key:
GVWJORQRVPCZSW-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)COC[C@@H]1CCCN1

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.178g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.355g/mol
Monoisotopic Mass:
233.178g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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