| CAS Number | 5058-42-4 |
| Catalog Number | AG003R1V(AGN-PC-0S8L9Q) |
| Chemical Name | Ethanol, iron(3+) salt (8CI,9CI) |
| EC Number | 225-760-2 |
| IUPAC Name | ethanolate;iron(3+) |
| InChI | InChI=1S/3C2H5O.Fe/c3*1-2-3;/h3*2H2,1H3;/q3*-1;+3 |
| InChI Key | JTPUGUWXHGEEHW-UHFFFAOYSA-N |
| MDL Number | MFCD00078028 |
| Molecular Formula | C2H6FeO |
| Molecular Weight | 101.9134 |
| SMILES | C(C)O.[Fe] |
| Synonyms | IRON(III) ETHOXIDE,
Iron(3+) ethanolate,
5058-42-4,
MFCD00078028,
Triethoxyiron(III),
EINECS 225-760-2,
ethanolate; iron(3+),
ACMC-1ALNR,
AC1O54YV,
CTK8C5605,
DTXSID20198599,
AKOS025295391,
TC-166513,
FT-0750133,
C2H6O.1/3Fe,
C2-H6-O.1/3Fe,
CID6452222,
Iron(III) ethoxide, 99.5% trace metals basis 500mg,
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| Complexity | 2.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.028g/mol |
| Monoisotopic Mass | 191.037g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 69.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number