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204316-62-1 | Hydrazinecarbodithioic acid, 2-[1-(2-furanyl)ethylidene]-, ethyl ester
CAS No: 204316-62-1 Catalog No: AG0029ED MDL No:
Product Description
Catalog Number:
AG0029ED
Chemical Name:
Hydrazinecarbodithioic acid, 2-[1-(2-furanyl)ethylidene]-, ethyl ester
CAS Number:
204316-62-1
Molecular Formula:
C9H12N2OS2
Molecular Weight:
228.3344
IUPAC Name:
ethyl N-[1-(furan-2-yl)ethylideneamino]carbamodithioate
InChI:
InChI=1S/C9H12N2OS2/c1-3-14-9(13)11-10-7(2)8-5-4-6-12-8/h4-6H,3H2,1-2H3,(H,11,13)
InChI Key:
BTXAMVMBEYFULS-UHFFFAOYSA-N
SMILES:
CCSC(=S)NN=C(c1ccco1)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.039g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.328g/mol
Monoisotopic Mass:
228.039g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
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