Home Aminos 1-[(2-aminoethyl)imino]-1lambda6-thiolan-1-one, oxalic acid

1-[(2-aminoethyl)imino]-1lambda6-thiolan-1-one, oxalic acid

CAS No.:
1955499-23-6
Catalog Number:
AG01B2JO
Molecular Formula:
C8H16N2O5S
Molecular Weight:
252.2880
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Product Description
Catalog Number:
AG01B2JO
Chemical Name:
1-[(2-aminoethyl)imino]-1lambda6-thiolan-1-one, oxalic acid
CAS Number:
1955499-23-6
Molecular Formula:
C8H16N2O5S
Molecular Weight:
252.2880
MDL Number:
MFCD29991633
IUPAC Name:
oxalic acid;2-[(1-oxothiolan-1-ylidene)amino]ethanamine
InChI:
InChI=1S/C6H14N2OS.C2H2O4/c7-3-4-8-10(9)5-1-2-6-10;3-1(4)2(5)6/h1-7H2;(H,3,4)(H,5,6)
InChI Key:
FSEQGTDBQZIICG-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.NCCN=S1(=O)CCCC1
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.078g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
252.285g/mol
Monoisotopic Mass:
252.078g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties