Dimethyldithiocarbamic acid, dimethylamine

HCID 11728

Notes Reactions

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Basic information

CAS: 598-64-1
Standard SMILES: CN(C)C(=S)[S-].C[NH2+]C
InChIKey: UVOFGKIRTCCNKG-UHFFFAOYSA-N
Molecular formula: C5H14N2S2
Average molar mass: 166.3 g/mol
Monoisotopic mass: 166.05984045

Overview

See also: Dimethylamine dimethyldithiocarbamate (preferred).

Names & identifiers

Preferred name: Dimethyldithiocarbamic acid, dimethylamine
IUPAC: dimethylazanium;N,N-dimethylcarbamodithioate
English name: Dimethyldithiocarbamic acid dimethylammonium salt
Molecular formula: C5H14N2S2
Molecular weight: 166.31

Names & synonyms

Dimethyldithiocarbamic acid, dimethylamineDTXSID6020513dimethylazanium;N,N-dimethylcarbamodithioateUNII-83515OR55BDTXCID60513Tox21_202587NCGC00260135-01CAS-598-64-1D0715N-Methylmethanaminium dimethylcarbamodithioateNS00080032Dimethylamine dimethyldithiocarbamate

Show more names

Dimethylamine dimethylcarbamodithioateDIMETHYLAMMONIUM DIMETHYLDITHIOCARBAMATEdimethyldithiocarbamicaciddimethylaminesaltimethylazanium,N,N-dimethylcarbamodithioateDimethylammonium N,N-dimethyldithiocarbamateDimethylammonium Dimethyldithiocarbamate >DIMETHYLDITHIOCARBAMICACIDDIMETHYLAMMLONIUMSALTDimethyldithiocarbamic acid diethylammonium saltdimethyldithio-carbamicacidimethylaminesalt(1:1)

Database identifiers

CAS: 598-64-1
PubChem CID: 11728
DTXSID: DTXSID6020513

Properties

Computed structural properties

Topological polar surface area: 52.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 57.1

Physicochemical properties

Melting point: 132 °C · 132°C
Density: 1.117 · 1.117 (estimate)
refractive index: 1.53 · 1.5300 (estimate)
form: powder to crystal
color: White to Light yellow
FDA UNII: 83515 OR55B · 83515OR55B
EPA Substance Registry System: Carbamodithioic acid, dimethyl-, compd. with N-methylmethanamine (1:1) (598-64-1)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36/37/39
RTECS: 250000 · FA0250000
TSCA: TSCA listed
HS Code: 2930.2 · 2930.20.9050

Safety & regulation

Safety data

tsca: TSCA listed
rtecs: FA0250000
hs_code: 2930.20.9050
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
safety_code: 26-36/37/39
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313