1-Boc-hexahydro-1,4-diazepine , ≥96% , 112275-50-0

Synonym(s):
tert-Butyl homopiperazine-1-carboxylate;1-Boc-homopiperazine

CAS NO.：112275-50-0

Empirical Formula: C10H20N2O2

Molecular Weight: 200.28

MDL number: MFCD00276987

EINECS: 628-955-4

PRODUCT Properties

• Melting point: 143.4 °C
• Boiling point: 110 °C/0.53 mmHg
• Density: 1.02
• refractive index: n 20/D 1.471 (lit.)
• Flash point: 110 °C
• storage temp.: Keep in dark place,Sealed in dry,Room Temperature
• pka: 10.45±0.20(Predicted)
• form: clear liquid
• color: Colorless to Light yellow to Light orange
• Specific Gravity: 1.016
• Water Solubility: Not miscible or difficult to mix in water.
• Sensitive: Air Sensitive
• BRN: 7581789
• InChI: InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-4-5-11-6-8-12/h11H,4-8H2,1-3H3
• InChIKey: WDPWEXWMQDRXAL-UHFFFAOYSA-N
• SMILES: N1(C(OC(C)(C)C)=O)CCCNCC1
• CAS DataBase Reference: 112275-50-0(CAS DataBase Reference)

Description and Uses

1-Boc-homopiperazine is used in synthesis of potent anticoagulant. It is also used to produce 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester by reaction with 11-bromo-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338
• target organs: Respiratory system
• PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• RIDADR: 2735
• WGK Germany: 3
• F: 10-34
• Hazard Note: Irritant
• HazardClass: IRRITANT, KEEP COLD
• HazardClass: 8
• HS Code: 29339900
• Storage Class: 10 - Combustible liquids
• Hazard Classifications: Eye Irrit. 2; Skin Irrit. 2; STOT SE 3