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158035-17-7 | 6H-1,3,4-Thiadiazine, 5-(1,1-dimethylethyl)-2-hydrazinyl-
CAS No: 158035-17-7 Catalog No: AG001PXA MDL No:MFCD07787615
Product Description
Catalog Number:
AG001PXA
Chemical Name:
6H-1,3,4-Thiadiazine, 5-(1,1-dimethylethyl)-2-hydrazinyl-
CAS Number:
158035-17-7
Molecular Formula:
C7H14N4S
Molecular Weight:
186.2779
MDL Number:
MFCD07787615
IUPAC Name:
(Z)-(5-tert-butyl-3,6-dihydro-1,3,4-thiadiazin-2-ylidene)hydrazine
InChI:
InChI=1S/C7H14N4S/c1-7(2,3)5-4-12-6(9-8)11-10-5/h4,8H2,1-3H3,(H,9,11)
InChI Key:
JSYWCHPLHXPDFM-UHFFFAOYSA-N
SMILES:
NNC1=NN=C(CS1)C(C)(C)C
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
186.094g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.277g/mol
Monoisotopic Mass:
186.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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