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137807-35-3 | Thiohydroxylamine, S-[(diethylamino)carbonyl]- (9CI)
CAS No: 137807-35-3 Catalog No: AG0013VH MDL No:
Product Description
Catalog Number:
AG0013VH
Chemical Name:
Thiohydroxylamine, S-[(diethylamino)carbonyl]- (9CI)
CAS Number:
137807-35-3
Molecular Formula:
C5H12N2OS
Molecular Weight:
148.2266
IUPAC Name:
S-amino N,N-diethylcarbamothioate
InChI:
InChI=1S/C5H12N2OS/c1-3-7(4-2)5(8)9-6/h3-4,6H2,1-2H3
InChI Key:
VFUAQDKVFQJXLN-UHFFFAOYSA-N
SMILES:
CCN(C(=O)SN)CC
Properties
Complexity:
93
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.067g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.224g/mol
Monoisotopic Mass:
148.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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