Product Name

  • Name

    (R,S)-1-(3,4-(METHYLENEDIOXY)-6-NITROPHENYL)ETHYL CHLOROFORMATE

  • EINECS
  • CAS No. 156876-26-5
  • Article Data5
  • CAS DataBase
  • Density 1.542 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H8ClNO6
  • Boiling Point 400.9 °C at 760 mmHg
  • Molecular Weight 273.6266
  • Flash Point 196.2 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 156876-26-5 ((R,S)-1-(3,4-(METHYLENEDIOXY)-6-NITROPHENYL)ETHYL CHLOROFORMATE)
  • Hazard Symbols
  • Synonyms 1-(3,4-(METHYLENEDIOXY)-6-NITROPHENYL)ETHYL CHLOROFORMATE;MENPOC;MENPOC CHLORIDE;(R,S)-1-(3,4-(METHYLENEDIOXY)-6-NITROPHENYL)ETHYL CHLOROFORMATE
  • PSA 90.58000
  • LogP 3.28310

Carbonochloridic acid,1-(6-nitro-1,3-benzodioxol-5-yl)ethyl ester Specification

The Carbonochloridic acid,1-(6-nitro-1,3-benzodioxol-5-yl)ethyl ester is an organic compound with the formula C10H8ClNO6. The systematic name of this chemical is (1S)-1-(6-Nitro-1,3-benzodioxol-5-yl)ethyl chlorocarbonate. With the CAS registry number 156876-26-5, it is also named as 1-(3,4-(Methylenedioxy)-6-nitrophenyl)ethyl chloroformate. Besides, its molecular weight is 273.63.

Physical properties about Carbonochloridic acid,1-(6-nitro-1,3-benzodioxol-5-yl)ethyl ester are: (1)ACD/LogP: 3.03; (2)ACD/LogD (pH 5.5): 3.03; (3)ACD/LogD (pH 7.4): 3.03; (4)ACD/BCF (pH 5.5): 119; (5)ACD/BCF (pH 7.4): 119; (6)ACD/KOC (pH 5.5): 1064.87; (7)ACD/KOC (pH 7.4): 1064.87; (8)#H bond acceptors: 7; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 90.58 Å2; (11)Index of Refraction: 1.588; (12)Molar Refractivity: 59.76 cm3; (13)Molar Volume: 177.3 cm3; (14)Polarizability: 23.69×10-24 cm3; (15)Surface Tension: 61.2 dyne/cm; (16)Density: 1.542 g/cm3; (17)Flash Point: 196.2 °C; (18)Enthalpy of Vaporization: 65.18 kJ/mol; (19)Boiling Point: 400.9 °C at 760 mmHg; (20)Vapour Pressure: 1.23E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H8ClNO6/c1-5(18-10(11)13)6-2-8-9(17-4-16-8)3-7(6)12(14)15/h2-3,5H,4H2,1H3/t5-/m0/s1
(2)InChIKey: LLQGXKKNTCFHEE-YFKPBYRVBY
(3)Std. InChI: InChI=1S/C10H8ClNO6/c1-5(18-10(11)13)6-2-8-9(17-4-16-8)3-7(6)12(14)15/h2-3,5H,4H2,1H3/t5-/m0/s1
(4)Std. InChIKey: LLQGXKKNTCFHEE-YFKPBYRVSA-N

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