Home Other Building Blocks 1-imino-1λ⁶-thiomorpholin-1-one hydrochloride

1-imino-1λ⁶-thiomorpholin-1-one hydrochloride

CAS No.:
1621962-33-1
Catalog Number:
AG00IXM2
Molecular Formula:
C4H11ClN2OS
Molecular Weight:
170.6609
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Product Description
Catalog Number:
AG00IXM2
Chemical Name:
1-imino-1λ⁶-thiomorpholin-1-one hydrochloride
CAS Number:
1621962-33-1
Molecular Formula:
C4H11ClN2OS
Molecular Weight:
170.6609
MDL Number:
MFCD30535579
IUPAC Name:
1-imino-1,4-thiazinane 1-oxide
InChI:
InChI=1S/C4H10N2OS/c5-8(7)3-1-6-2-4-8/h5-6H,1-4H2
InChI Key:
LVKJUNIPYABARM-UHFFFAOYSA-N
SMILES:
N=S1(=O)CCNCC1.Cl
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.051g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
134.197g/mol
Monoisotopic Mass:
134.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties