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101373-58-4 | Pyrrolidinium, 1-(chloro-1-pyrrolidinylmethylene)-, chloride (1:1)
CAS No: 101373-58-4 Catalog No: AG0004B3 MDL No:
Product Description
Catalog Number:
AG0004B3
Chemical Name:
Pyrrolidinium, 1-(chloro-1-pyrrolidinylmethylene)-, chloride (1:1)
CAS Number:
101373-58-4
Molecular Formula:
C9H16Cl2N2
Molecular Weight:
223.1427
IUPAC Name:
1-[chloro(pyrrolidin-1-ium-1-ylidene)methyl]pyrrolidine;chloride
InChI:
InChI=1S/C9H16ClN2.ClH/c10-9(11-5-1-2-6-11)12-7-3-4-8-12;/h1-8H2;1H/q+1;/p-1
InChI Key:
NYPPZXFHFBBWJR-UHFFFAOYSA-M
SMILES:
ClC(=[N+]1CCCC1)N1CCCC1.[Cl-]
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.141g/mol
Monoisotopic Mass:
222.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
6.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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