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156004-71-6 | Pyrrolidine, 1-[1-(2-naphthalenyl)ethenyl]-
CAS No: 156004-71-6 Catalog No: AG001OGH MDL No:
Product Description
Catalog Number:
AG001OGH
Chemical Name:
Pyrrolidine, 1-[1-(2-naphthalenyl)ethenyl]-
CAS Number:
156004-71-6
Molecular Formula:
C16H17N
Molecular Weight:
223.3129
IUPAC Name:
1-(1-naphthalen-2-ylethenyl)pyrrolidine
InChI:
InChI=1S/C16H17N/c1-13(17-10-4-5-11-17)15-9-8-14-6-2-3-7-16(14)12-15/h2-3,6-9,12H,1,4-5,10-11H2
InChI Key:
DFPVZMDOLNQPSM-UHFFFAOYSA-N
SMILES:
C=C(c1ccc2c(c1)cccc2)N1CCCC1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.136g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.319g/mol
Monoisotopic Mass:
223.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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