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114640-28-7 | Pyrrolidine, 2-ethyl-5-undecyl-, trans- (9CI)
CAS No: 114640-28-7 Catalog No: AG000EWS MDL No:
Product Description
Catalog Number:
AG000EWS
Chemical Name:
Pyrrolidine, 2-ethyl-5-undecyl-, trans- (9CI)
CAS Number:
114640-28-7
Molecular Formula:
C17H35N
Molecular Weight:
253.4665
IUPAC Name:
2-ethyl-5-undecylpyrrolidine
InChI:
InChI=1S/C17H35N/c1-3-5-6-7-8-9-10-11-12-13-17-15-14-16(4-2)18-17/h16-18H,3-15H2,1-2H3
InChI Key:
RMFYXDMSZZLTTD-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC[C@H]1CC[C@@H](N1)CC
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.277g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.474g/mol
Monoisotopic Mass:
253.277g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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