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16214-16-7 | Ethanamine, 2,2'-dithiobis-, sulfate (1:?)
CAS No: 16214-16-7 Catalog No: AG001SSH MDL No:MFCD00060254
Product Description
Catalog Number:
AG001SSH
Chemical Name:
Ethanamine, 2,2'-dithiobis-, sulfate (1:?)
CAS Number:
16214-16-7
Molecular Formula:
C4H14N2O4S3
Molecular Weight:
250.3600
MDL Number:
MFCD00060254
IUPAC Name:
2-(2-aminoethyldisulfanyl)ethanamine;sulfuric acid
InChI:
InChI=1S/C4H12N2S2.H2O4S/c5-1-3-7-8-4-2-6;1-5(2,3)4/h1-6H2;(H2,1,2,3,4)
InChI Key:
XVCYODCCYCPADG-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.NCCSSCCN
EC Number:
240-340-9
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.012g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
250.346g/mol
Monoisotopic Mass:
250.012g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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