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83419-63-0 | Pyrrolidine, 1-(5-chloro-1H-inden-3-yl)-
CAS No: 83419-63-0 Catalog No: AG004RT8 MDL No:
Product Description
Catalog Number:
AG004RT8
Chemical Name:
Pyrrolidine, 1-(5-chloro-1H-inden-3-yl)-
CAS Number:
83419-63-0
Molecular Formula:
C13H14ClN
Molecular Weight:
219.7100
IUPAC Name:
1-(6-chloro-3H-inden-1-yl)pyrrolidine
InChI:
InChI=1S/C13H14ClN/c14-11-5-3-10-4-6-13(12(10)9-11)15-7-1-2-8-15/h3,5-6,9H,1-2,4,7-8H2
InChI Key:
WNJCKEZIZRCUMP-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(=CC2)N1CCCC1
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.081g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.712g/mol
Monoisotopic Mass:
219.081g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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