Diphenyltin dichloride - analytical standard , CAS No.1135-99-5

CAS: 1135-99-5 Cat. No.: D114143 Molecular Weight: 343.82 EC Number: 214-496-3

GRADE & PURITY Analytical standard

Synonyms

DICHLOROBIS(PHENYL)TIN | Diphenyldichlorotin | MFCD00000516 | Diphenyltindichloride | WLN: G-SN-GR&R | ?DIPHENYLTIN DICHLORIDE | Diphenyltin dichloride, 96% | Stannane,dichlorodiphenyl- | Difenylstanniumdichlorid | Dichlorodiphenyltin | Diphenylstannium d

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

DICHLOROBIS(PHENYL)TIN | Diphenyldichlorotin | MFCD00000516 | Diphenyltindichloride | WLN: G-SN-GR&R | ?DIPHENYLTIN DICHLORIDE | Diphenyltin dichloride, 96% | Stannane, dichlorodiphenyl- | Difenylstanniumdichlorid | Dichlorodiphenyltin | Diphenylstannium d

Specifications & Purity

analytical standard

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Analytical standard

Names and Identifiers

• Canonical Smiles: C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(Cl)Cl
• IUPAC Name: dichloro(diphenyl)stannane
• InChIKey: ISXUHJXWYNONDI-UHFFFAOYSA-L
• INCHI: 1S/2C6H5.2ClH.Sn/c2*1-2-4-6-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2
• Isomeric SMILES: C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(Cl)Cl
• WGK Germany: 3
• RTECS: WH7253000
• UN Number: 3146
• Molecular Weight: 343.82
• Reaxy-Rn: 4134437
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4134437&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Metal aryls Organo-post-transition metal compounds Organic tin salts Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Metal aryl - Monocyclic benzene moiety - Organic metal salt - Hydrocarbon derivative - Organic tin salt - Organic salt - Organometallic compound - Organic post-transition metal moeity - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Moisture Sensitive
• Flash Point(°F): >230 °F
• Flash Point(°C): >230°F
• Boil Point(°C): 333-337°C
• Melt Point(°C): 41-43°C
• Molecular Weight: 343.800 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 343.918 Da
• Monoisotopic Mass: 343.918 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 174.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

XLogP3

References

1. Huiyu He, Miaomiao Tian, Lihuan Hu, Li Yang.  (2020)  Ultrasensitive determination of organotin compounds in plastic food packaging and edible oils by sheathless capillary electrophoresis-electrospray ionization-mass spectrometry.  ANALYST,  145  (6): (2286-2296).  [PMID:32003368] [10.1039/C9AN02331C]

2. Jiamiao Wang, Jurong Lv, Zheyu Shen, Yan Liu, Xia Gao, Qiang Chen, Pei Liang.  (2025)  Development of rapid and data-driven detection methods for organotin compounds from microplastics: Integrating theoretical and experimental Raman and SERS database.  MICROCHEMICAL JOURNAL,      [PMID:] [10.1016/j.microc.2025.112836]