Bis(4-chloro-2-nitrophenyl) Disulfide - CAS 2050-66-0
Catalog: |
BB016021 |
Product Name: |
Bis(4-chloro-2-nitrophenyl) Disulfide |
CAS: |
2050-66-0 |
Synonyms: |
4-chloro-1-[(4-chloro-2-nitrophenyl)disulfanyl]-2-nitrobenzene; 4-chloro-1-[(4-chloro-2-nitrophenyl)disulfanyl]-2-nitrobenzene |
IUPAC Name: | 4-chloro-1-[(4-chloro-2-nitrophenyl)disulfanyl]-2-nitrobenzene |
Description: | Bis(4-chloro-2-nitrophenyl) Disulfide (CAS# 2050-66-0) is a building block used in various chemical synthesis such as in the preparation of novel benzothiazine derivatives. |
Molecular Weight: | 377.22 |
Molecular Formula: | C12H6Cl2N2O4S2 |
Canonical SMILES: | C1=CC(=C(C=C1Cl)[N+](=O)[O-])SSC2=C(C=C(C=C2)Cl)[N+](=O)[O-] |
InChI: | InChI=1S/C12H6Cl2N2O4S2/c13-7-1-3-11(9(5-7)15(17)18)21-22-12-4-2-8(14)6-10(12)16(19)20/h1-6H |
InChI Key: | DESADCWXGJLRSR-UHFFFAOYSA-N |
Boiling Point: | 476.9 °C at 760 mmHg |
Density: | 1.68 g/cm3 |
MDL: | MFCD00047692 |
LogP: | 6.65560 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P273, P280, P305+P351+P338, P337+P313, P391, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021103212-A | Ink composition, laminate using the composition, light wavelength conversion layer, light wavelength conversion member and color filter | 20191225 |
JP-2021081607-A | Light wavelength conversion member and light emitting device | 20191120 |
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JP-2020086074-A | Semiconductor fine particle composition and use thereof | 20181122 |
JP-2020076035-A | Luminescent composition and use thereof | 20181109 |
Complexity: | 383 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 375.9146044 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 375.9146044 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 142 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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