511382

1-Boc-hexahydro-1,4-diazepine

98%

• Synonym(s): 1-Boc-homopiperazine, tert-Butyl homopiperazine-1-carboxylate
• Empirical Formula (Hill Notation): C₁₀H₂₀N₂O₂
• CAS Number: 112275-50-0
• Molecular Weight: 200.28
• Beilstein: 7581789
• MDL number: MFCD00276987
• UNSPSC Code: 12352100
• PubChem Substance ID: 24873442
• NACRES: NA.22

Properties

• Assay: 98%
• refractive index: n20/D 1.471 (lit.)
• bp: 95-110 °C/0.5 mmHg (lit.)
• density: 1.016 g/mL at 20 °C (lit.)
• SMILES string: CC(C)(C)OC(=O)N1CCCNCC1
• InChI: 1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-4-5-11-6-8-12/h11H,4-8H2,1-3H3
• InChI key: WDPWEXWMQDRXAL-UHFFFAOYSA-N

Description

General description

1-Boc-hexahydro-1,4-diazepine is an N-boc protected homopiperazine. Its enthalpy of vaporization at boiling point (558.15K) is 49.498kjoule/mol.

Application

Used in synthesis of potent anticoagulant.

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H315,H319,H335
• Precautionary Statements: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): 230.0 °F - closed cup
• Flash Point(C): 110 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves