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Phytic acid

CAS Registry Number®

83-86-3

CAS Name

Phytic acid

Molecular Formula

C6H18O24P6

Molecular Mass

660.04

Cite this Page

Phytic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83-86-3 (retrieved 2024-12-29) (CAS RN: 83-86-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    <25 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)/t1-,2-,3-,4+,5-,6-

InChIKey

InChIKey=IMQLKJBTEOYOSI-GPIVLXJGNA-N

SMILES

O(P(=O)(O)O)[C@H]1[C@@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@@H]1OP(=O)(O)O

Canonical SMILES

O=P(O)(O)OC1C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1OP(=O)(O)O

Other Names for this Substance

  • myo-Inositol, 1,2,3,4,5,6-hexakis(dihydrogen phosphate)
  • Inositol, hexakis(dihydrogen phosphate), myo-
  • myo-Inositol, hexakis(dihydrogen phosphate)
  • Fytic acid
  • Phytic acid

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Deleted or Replaced CAS Registry Numbers

50762-79-3, 78039-41-5, 894854-44-5, 1206549-44-1, 1242436-18-5

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