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102372-32-7 | Pyrrolidine, 1-butyl-3-(diphenylmethoxy)-
CAS No: 102372-32-7 Catalog No: AG0007AD MDL No:
Product Description
Catalog Number:
AG0007AD
Chemical Name:
Pyrrolidine, 1-butyl-3-(diphenylmethoxy)-
CAS Number:
102372-32-7
Molecular Formula:
C21H27NO
Molecular Weight:
309.4452
IUPAC Name:
3-benzhydryloxy-1-butylpyrrolidine
InChI:
InChI=1S/C21H27NO/c1-2-3-15-22-16-14-20(17-22)23-21(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,20-21H,2-3,14-17H2,1H3
InChI Key:
QFGBDMAJXGJVDT-UHFFFAOYSA-N
SMILES:
CCCCN1CCC(C1)OC(c1ccccc1)c1ccccc1
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.209g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.453g/mol
Monoisotopic Mass:
309.209g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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