diamine sulfane

• ChemBase ID: 130850
• Molecular Formular: N2S
• Molecular Mass: 60.0784
• Monoisotopic Mass: 59.97821901
• SMILES: N.N.S
• Canonical SMILES: N.N.S
• InChI: InChI=1S/2H3N.H2S/h2*1H3;1H2
• InChIKey: UXXGWUQNRMPNKH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diamine sulfane
• IUPAC Traditional name: diamine sulfane
• Synonyms: Ammonium sulfide solution; 硫化铵 溶液

Database IDs

• CAS Number: 12135-76-1
• MDL Number: MFCD00010892
• PubChem SID: 24900820; 162225128; 24873847; 24890606
• PubChem CID: 21842493
• FEMA ID: 2053
• Council of Europe Number: 482
• Flavis Number: 16.002

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -3.7525723
• LogD (pH = 7.4): -2.4393091
• Log P: -0.978
• Molar Refractivity: 15.5149 cm^3
• Polarizability: 2.2600515 Å^3
• Polar Surface Area: 13.59 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: yellow
• Boiling Point: 40 °C
• Flash Point: 20 °C; 32 °C; 68 °F; 89.6 °F
• Density: 0.997 g/mL at 25 °C; 1 g/mL at 25 °C
• Refractive Index: n20/D 1.388; n20/D 1.467
• Organoleptic: sulfurous

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F); Nature polluting (N)
• UN Number: 2683
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 10-31-34-50; 11-31-34-50
• Safety Statements: 16-26-36/37/39-45-61; 26-36/37/39-45-61
• GHS Pictograms: GHS02; GHS05; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H314-H400; H226-H314-H400
• GHS Precautionary statements: P210-P273-P280-P305 + P351 + P338-P310; P273-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US); Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2683 8/PG 2
• Supplemental Hazard Statements: Contact with acids liberates toxic gas.
• Regulation Compliance: EU Regulation 1334/2008 & 178/2002; FDA 21 CFR (172.515)

Pharmacology Properties

• Allergens: no known allergens

Product Information

• Concentration: ~21% in H2O (RT); 20 wt. % in H2O; 20% in H2O; 40-48 wt. % in H2O; 5-6% S
• Grade: Halal; Kosher; purum; SAJ first grade
• Linear Formula: (NH4)2S

DETAILS

Sigma Aldrich - W205303

Packaging
1 kg in glass bottle
1 sample in glass bottle
5, 25 kg in ss drum

Sigma Aldrich - A1952

包装
25, 500 mL in glass bottle

Sigma Aldrich - 515809

Packaging
100, 500 mL in glass bottle