1,2-Diisothiocyanatoethane
Completing data — refresh the page later to see the latest
Basic information
- CAS
3688-08-2- Standard SMILES
S=C=NCCN=C=S- InChIKey
KVUYSIIZYQUVMT-UHFFFAOYSA-N- Molecular formula
- C4H4N2S2
- Average molar mass
- 144.2 g/mol
- Monoisotopic mass
- 143.98159048
Overview
decomposition product of ethylenebis(dithiocarbamate)
Names & identifiers
- Preferred name
- 1,2-Diisothiocyanatoethane
- IUPAC
- 1,2-diisothiocyanatoethane
- English name
- ethylenebis(isothiocyanate)
- Molecular formula
- C4H4N2S2
- Molecular weight
- 144.22
Names & synonyms
1,2-DiisothiocyanatoethaneEthylenebis(isothiocyanate)EBISEthylenebisisothiocyanate3688-08-2Ethane, 1,2-diisothiocyanato-ethylene-bis-isothiocyanateDTXSID201903565P5ZDE3JNYisothiocyanic acid ethylene esterRefChem:139148DTXCID30112847
Show more names
EthylenediisothiocyanateEthane-1,2-diyldiisothiocyanateISOTHIOCYANICACID,ETHYLENEESTEREthylenebis(isothiocyanate) DISCONTINUED.
Senfol [German]AETM [German]AethylsenfoelAethylsenfoel [German]SenfolEthylene diisothiocyanateDimethylene diisothiocyanateAETM
Database identifiers
- CAS
3688-08-2- PubChem CID
- 19388
- DTXSID
DTXSID20190356- UNII
- 5P5ZDE3JNY
- Nikkaji
- J36.794J
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 88.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Boiling point
- 151.5 · 151.5-152.0 °C
- Density
- 1.391 · 1.391 (estimate)
- refractive index
- 1.5 · 1.5000 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…