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16853-10-4 | Pyrrolizinium, 1,2,3,5,6,7-hexahydro-, perchlorate (1:1)
CAS No: 16853-10-4 Catalog No: AG001Y4X MDL No:
Product Description
Catalog Number:
AG001Y4X
Chemical Name:
Pyrrolizinium, 1,2,3,5,6,7-hexahydro-, perchlorate (1:1)
CAS Number:
16853-10-4
Molecular Formula:
C7H12ClNO4
Molecular Weight:
209.6275
IUPAC Name:
1,2,3,5,6,7-hexahydropyrrolizin-4-ium;perchlorate
InChI:
InChI=1S/C7H12N.ClHO4/c1-3-7-4-2-6-8(7)5-1;2-1(3,4)5/h1-6H2;(H,2,3,4,5)/q+1;/p-1
InChI Key:
SJOPDOYYINOFEH-UHFFFAOYSA-M
SMILES:
C1C[N+]2=C(C1)CCC2.[O-][Cl](=O)(=O)=O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.626g/mol
Monoisotopic Mass:
209.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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