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13331-31-2 | Hydrazinecarbodithioic acid, phenylmethyl ester
CAS No: 13331-31-2 Catalog No: AG0014LS MDL No:
Product Description
Catalog Number:
AG0014LS
Chemical Name:
Hydrazinecarbodithioic acid, phenylmethyl ester
CAS Number:
13331-31-2
Molecular Formula:
C8H10N2S2
Molecular Weight:
198.3084
IUPAC Name:
benzyl N-aminocarbamodithioate
InChI:
InChI=1S/C8H10N2S2/c9-10-8(11)12-6-7-4-2-1-3-5-7/h1-5H,6,9H2,(H,10,11)
InChI Key:
XDAPOZNYUAPWCC-UHFFFAOYSA-N
SMILES:
NNC(=S)SCc1ccccc1
NSC Number:
244036
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.302g/mol
Monoisotopic Mass:
198.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| {S-Benzyl 3-[(6-methyl-pyridin-2-yl-κN)methyl-idene]dithio-carbazato-κ(2)N(3),S}zinc. | Acta crystallographica. Section E, Structure reports online 20120501 |
| 1-(5-Benzyl-sulfanyl-2,2-dimethyl-2,3-dihydro-1,3,4-thia-diazol-3-yl)-2,2-dimethyl-propan-1-one. | Acta crystallographica. Section E, Structure reports online 20120401 |
| Benzyl (E)-3-(4-meth-oxy-benzyl-idene)dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20111101 |
| Benzyl (E)-3-(2-bromo-5-meth-oxy-benzyl-idene)dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20111101 |
| Benzyl (E)-3-(2-methyl-benzyl-idene)dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20110901 |
| Benzyl 3-[(E)-1-(pyrazin-2-yl)ethyl-idene]dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20110801 |
| Benzyl 3-[(E)-2-nitro-benzyl-idene]dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20110801 |
| DNA Binding and Antitumor Activity of α-Diimineplatinum(II) and Palladium(II) Dithiocarbamate Complexes. | Bioinorganic chemistry and applications 20110101 |
| (E)-Benzyl 3-(3-nitro-benzyl-idene)dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20091201 |
| (E)-4-Chloro-benzyl 3-(3-nitro-benzyl-idene)dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20091201 |
| Substoichiometric extraction of silver(I) by S-benzyl dithiocarbazate into chloroform. | Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20091001 |
| Benzyl N'-(4,6-dimeth-oxy-2-methyl-3-phenyl-1H-indol-7-ylmethyl-ene)hydrazinecarbodithio-ate. | Acta crystallographica. Section E, Structure reports online 20081201 |
| Benzyl 3-[(E)-benzyl-idene]dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20080601 |
| Benzyl 3-[(E)-furfuryl-idene]dithio-carbazate. | Acta crystallographica. Section E, Structure reports online 20080601 |
| Synthesis and structure-activity relationships of metal-ligand complexes that potently inhibit cell migration. | Bioorganic & medicinal chemistry letters 20080115 |
| Benzyl 5-ferrocenyl-3-(4-methyl-phen-yl)-2-pyrazoline-1-dithio-carboxyl-ate. | Acta crystallographica. Section E, Structure reports online 20080101 |
| Synthetic, structural, and biochemical studies of organotin(IV) with Schiff bases having nitrogen and sulphur donor ligands. | Bioinorganic chemistry and applications 20060101 |
| Biological activity of palladium(II) and platinum(II) complexes of the acetone Schiff bases of S-methyl- and S-benzyldithiocarbazate and the X-ray crystal structure of the [Pd(asme)2] (asme=anionic form of the acetone Schiff base of S-methyldithiocarbazate) complex. | Journal of inorganic biochemistry 20021125 |
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