Methylene bis(thiocyanate)

C₃H₂N₂S₂CAS 6317-18-6130.18 g/mol

Open in Covalent MOL file

Nitrile Sulfide

Properties

Molecular formula: C₃H₂N₂S₂
Molar mass: 130.18 g/mol
Exact mass: 129.9659 Da
Melting point: 105–107 °C
logP: 1.37Crippen estimate
Polar surface area: 47.6 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

Identifiers

CAS number

6317-18-6

SMILES

N#CSCSC#N

InChIKey

JWZXKXIUSSIAMR-UHFFFAOYSA-N

InChI

InChI=1S/C3H2N2S2/c4-1-6-3-7-2-5/h3H2

Weigh it out

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Names and synonyms

22 names · show all

Thiocyanic acid, C,C′-methylene ester
Thiocyanic acid, methylene ester
Methylene dithiocyanate
Methylene thiocyanate
Methylenedirhodanide
Nalfloc N 206
Proxel MB
V 709
Kilstain
Slimicide MC
Antiblu 3737
Antiblu 3738
Busan 110
Nalco D 2303
Bis(thiocyanato)methane
Dithiocyanomethane
Basiment 540
Nalco 5793
Metasol T 10
MBT
NSC 40464
WT 307B

Work with Methylene bis(thiocyanate)

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Chloromethyl thiocyanate3268-79-950 % similar Ethyl thiocyanate542-90-550 % similar Methyl thiocyanate556-64-941 % similar Butyl thiocyanate628-83-141 % similar Tropeolin3012-37-139 % similar Pentyl thiocyanate32446-40-539 % similar Tcmtb21564-17-035 % similar 1-(4-Chlorophenyl)-2-thiocyanatoethanone19339-59-431 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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