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13070-03-6 | 2,5-Pyrrolidinedithione
CAS No: 13070-03-6 Catalog No: AG000UUA MDL No:MFCD12923835
Product Description
Catalog Number:
AG000UUA
Chemical Name:
2,5-Pyrrolidinedithione
CAS Number:
13070-03-6
Molecular Formula:
C4H5NS2
Molecular Weight:
131.2192
MDL Number:
MFCD12923835
IUPAC Name:
pyrrolidine-2,5-dithione
InChI:
InChI=1S/C4H5NS2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
InChI Key:
MUXZKVJISOKIEW-UHFFFAOYSA-N
SMILES:
S=C1CCC(=S)N1
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.986g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
131.211g/mol
Monoisotopic Mass:
130.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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