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Technology Process of 3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid

3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid

Base Information
  • Chemical Name:3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid
  • CAS No.:139663-56-2
  • Molecular Formula:C45H60 N4 O14
  • Molecular Weight:880.99
  • Hs Code.:
  • DSSTox Substance ID:DTXSID601098577
3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid

Synonyms:precorrin 8x;precorrin-8x

Suppliers and Price of 3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid
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Chemical Property of 3-[(4Z,15Z)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,5,7,10,11,12,17-octamethyl-3,10,18,19,21,24-hexahydrocorrin-3-yl]propanoic acid
Chemical Property:
  • Vapor Pressure:0mmHg at 25°C 
  • Boiling Point:1099.3°Cat760mmHg 
  • Flash Point:618.6°C 
  • PSA：309.88000 
  • Density:1.43g/cm3 
  • LogP:5.02960 
  • XLogP3:0.7
  • Hydrogen Bond Donor Count:9
  • Hydrogen Bond Acceptor Count:18
  • Rotatable Bond Count:18
  • Exact Mass:880.41060260
  • Heavy Atom Count:63
  • Complexity:2240
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC1C2=C(C(C(=N2)C(=C3C(C(C(N3)(C4C(C(C(=CC5=NC1(C(=C5CCC(=O)O)C)C)N4)(C)CCC(=O)O)CC(=O)O)C)(C)CC(=O)O)CCC(=O)O)C)(C)CC(=O)O)CCC(=O)O
  • Isomeric SMILES:CC1C2=C(C(C(=N2)/C(=C\3/C(C(C(N3)(C4C(C(/C(=C/C5=NC1(C(=C5CCC(=O)O)C)C)/N4)(C)CCC(=O)O)CC(=O)O)C)(C)CC(=O)O)CCC(=O)O)/C)(C)CC(=O)O)CCC(=O)O
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