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23515-29-9 | 2H-1,3,5-Thiadiazine-2-thione, 3-(3,4-dichlorophenyl)tetrahydro-5-methyl-
CAS No: 23515-29-9 Catalog No: AG002NIX MDL No:
Product Description
Catalog Number:
AG002NIX
Chemical Name:
2H-1,3,5-Thiadiazine-2-thione, 3-(3,4-dichlorophenyl)tetrahydro-5-methyl-
CAS Number:
23515-29-9
Molecular Formula:
C10H10Cl2N2S2
Molecular Weight:
293.2358
IUPAC Name:
3-(3,4-dichlorophenyl)-5-methyl-1,3,5-thiadiazinane-2-thione
InChI:
InChI=1S/C10H10Cl2N2S2/c1-13-5-14(10(15)16-6-13)7-2-3-8(11)9(12)4-7/h2-4H,5-6H2,1H3
InChI Key:
QAYODENXMUMJAX-UHFFFAOYSA-N
SMILES:
CN1CSC(=S)N(C1)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.966g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.224g/mol
Monoisotopic Mass:
291.966g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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