| CAS Number | 19163-92-9 |
| Catalog Number | AG002FDS(AGN-PC-0QKMNU) |
| Chemical Name | Bis(di(2-hydroxyethyl)dithiocarbamato)zinc |
| EC Number | 242-852-8 |
| IUPAC Name | zinc;N,N-bis(2-hydroxyethyl)carbamodithioate |
| InChI | InChI=1S/2C5H11NO2S2.Zn/c2*7-3-1-6(2-4-8)5(9)10;/h2*7-8H,1-4H2,(H,9,10);/q;;+2/p-2 |
| InChI Key | BRJVMKALQCUXPN-UHFFFAOYSA-L |
| MDL Number | MFCD00070508 |
| Molecular Formula | C10H20N2O4S4Zn |
| Molecular Weight | 425.9168 |
| SMILES | OCCN(C1=[S][Zn+2]2([S]=C([S-]2)N(CCO)CCO)[S-]1)CCO |
| Synonyms | 19163-92-9,
zinc N,N-bis(2-hydroxyethyl)carbamodithioate,
Bis(2-hydroxyethyl)dithiocarbamic Acid Zinc(II) Salt,
EINECS 242-852-8,
AC1LBBSG,
AC1L3EQE,
zinc bis[bis(2-hydroxyethyl)carbamodithioate],
SCHEMBL14880191,
CTK8A4528,
B0492,
FT-0754861,
Bis[bis(2-hydroxyethyl)dithiocarbamato]zinc(II),
Bis(bis(2-hydroxyethyl)dithiocarbamato-S,S')zinc,
Bis[bis(2-hydroxyethyl)dithiocarbamic acid]zinc salt,
CID87948,
AR-1L8337,
Bis(2-hydroxyethyl)dithiocarbamic Acid Zinc Salt,
19598-11-9,
|
| Complexity | 98.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 423.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 425.9g/mol |
| Monoisotopic Mass | 423.96g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 154A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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