Product Name

  • Name

    4,6-dichloro-7H-pyrrolo[2,3-d]pyrimidine

  • EINECS
  • CAS No. 97337-32-1
  • Article Data2
  • CAS DataBase
  • Density 1.675 g/cm3
  • Solubility
  • Melting Point
  • Formula C6H3Cl2N3
  • Boiling Point
  • Molecular Weight 188.016
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 97337-32-1 (4,6-dichloro-7H-pyrrolo[2,3-d]pyrimidine)
  • Hazard Symbols
  • Synonyms 1H-Pyrrolo[2,3-d]pyrimidine,4,6-dichloro- (9CI);4,6-Dichloro-7H-pyrrolo[2,3-d]pyrimidine;
  • PSA 41.57000
  • LogP 2.26470

4,6-Dichloro-7H-pyrrolo[2,3-d]pyrimidine Specification

The CAS register number of 4,6-Dichloro-7H-pyrrolo[2,3-d]pyrimidine is 97337-32-1. It also can be called as 7H-Pyrrolo[2,3-d]pyrimidine,4,6-dichloro- and the systematic name about this chemical is 4,6-dichloro-7H-pyrrolo[2,3-d]pyrimidine. The molecular formula about this chemical is C6H3Cl2N3 and molecular weight is 188.01. It belongs to the Chiral Chemicals.

Physical properties about 4,6-Dichloro-7H-pyrrolo[2,3-d]pyrimidine are: (1)ACD/LogP: 1.41; (2)ACD/LogD (pH 5.5): 1.41; (3)ACD/LogD (pH 7.4): 1.41; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)Polar Surface Area: 41.57Å2; (7)Index of Refraction: 1.723; (8)Molar Refractivity: 44.5 cm3; (9)Molar Volume: 112.2 cm3; (10)Polarizability: 17.64x10-24cm3; (11)Surface Tension: 75.4 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2c([nH]c1Cl)ncnc2Cl
(2)InChI: InChI=1/C6H3Cl2N3/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H,(H,9,10,11)
(3)InChIKey: CGTRULURZFVPIX-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H3Cl2N3/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H,(H,9,10,11)
(5)Std. InChIKey: CGTRULURZFVPIX-UHFFFAOYSA-N

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