Product Name

  • Name

    4-Morpholinecarbonyl chloride

  • EINECS 239-213-0
  • CAS No. 15159-40-7
  • Article Data47
  • CAS DataBase
  • Density 1.304 g/cm3
  • Solubility
  • Melting Point
  • Formula C5H8ClNO2
  • Boiling Point 238.7 °C at 760 mmHg
  • Molecular Weight 149.577
  • Flash Point 113.9 °C
  • Transport Information UN 3265 8/PG 2
  • Appearance
  • Safety 26-30-36-38
  • Risk Codes 14-36/38-40
  • Molecular Structure Molecular Structure of 15159-40-7 (4-Morpholinecarbonyl chloride)
  • Hazard Symbols HarmfulXn
  • Synonyms 4-(Chlorocarbonyl)morpholine;4-(Chloroformyl)morpholine;4-Morpholinecarboxylic acid chloride;4-Morpholinocarbonyl chloride;Morpholine, 4-(chlorocarbonyl)-;Morpholinocarbonyl chloride;N-Chlorocarbonylmorpholine;N-Morpholinecarbonylchloride;NSC 50226;
  • PSA 29.54000
  • LogP 0.61530

4-Morpholinecarbonyl chloride Specification

The 4-Morpholinecarbonyl chloride with the CAS number 15159-40-7 is also called 4-Morpholinecarboxylic acid chloride. Both the systematic name and IUPAC name are morpholine-4-carbonyl chloride. Its EINECS registry number is 239-213-0. The molecular formula is C5H8ClNO2. This chemical belongs to the following product categories: (1)Acidhalide; (2)Phosgene Derivatives; (3)Building Blocks; (4)Heterocyclic Building Blocks; (5)Morpholines.

The properties of the chemical are: (1)ACD/LogP: -0.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.54; (4)ACD/LogD (pH 7.4): -0.54; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 12.17; (8)ACD/KOC (pH 7.4): 12.17; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 29.54Å2; (13)Index of Refraction: 1.487; (14)Molar Refractivity: 33.04 cm3; (15)Molar Volume: 114.6 cm3; (16)Polarizability: 13.09×10-24cm3; (17)Surface Tension: 41.6 dyne/cm; (18)Enthalpy of Vaporization: 47.56 kJ/mol; (19)Vapour Pressure: 0.0418 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(=O)N1CCOCC1
(2)InChI: InChI=1/C5H8ClNO2/c6-5(8)7-1-3-9-4-2-7/h1-4H2
(3)InChIKey: XMWFMEYDRNJSOO-UHFFFAOYAL

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