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13355-96-9

Basic Information
CAS No.: 13355-96-9
Name: Butylchlorodihydroxytin
Molecular Structure:
Molecular Structure of 13355-96-9 (Butylchlorodihydroxytin)
Formula: C4H11ClO2Sn
Molecular Weight: 245.293
Synonyms: Butyl(chloro)dihydroxystannane;Butyl(chloro)stannanediol;Butylchlorotin dihydroxide;Butyltin chloridedihydroxide;Butyltin dihydroxychloride;Fascat 4101;NSC 323990;
EINECS: 236-406-1
Density: 1.26 g/cm3
Melting Point: 150 °C (dec.)(lit.)
Boiling Point: 243.219 °C at 760 mmHg
Flash Point: 100.896 °C
Solubility: 1.03mg/L at 20℃
Hazard Symbols: HarmfulXn
Risk Codes: 20/21/22-36/37/38
Safety: 26-37/39
PSA: 40.46000
LogP: 0.94880
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    Specifications CAS No.: 13355-96-9 Other Names: Butylchlorodihydroxystannane MF: C4H11ClO2Sn EINECS No.: 236-406-1 Place of Origin: Shandong, China (Mainland) Type: Pharmaceutical Intermediates Purity: 99% Brand Name: Luyunjia Model

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  • Butylchlorodihydroxytin

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    Butylchlorodihydroxytin

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Specification

The CAS registry number of Butylchlorodihydroxytin is 13355-96-9. In addition, the molecular formula is C4H11ClO2Sn and the molecular weight is 245.29. The systematic name is butyl-chloro-dihydroxy-stannane. What's more, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about Butylchlorodihydroxytin are: (1)ACD/LogP: 5.83; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.3; (4)ACD/LogD (pH 7.4): 1.32; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 40.46 Å2; (9)Flash Point: 100.9 °C; (10)Enthalpy of Vaporization: 55.81 kJ/mol; (11)Boiling Point: 243.2 °C at 760 mmHg; (12)Vapour Pressure: 0.00551 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. Whenever you will contact it, please wear gloves and eye/face protection. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCC[Sn](Cl)(O)O
(2)Std.InChI: InChI=1S/C4H9.ClH.2H2O.Sn/c1-3-4-2;;;;/h1,3-4H2,2H3;1H;2*1H2;/q;;;;+3/p-3
(3)Std.InChIKey: FQYHHEJETOLDHR-UHFFFAOYSA-K