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Carbamimidothioic acid,3-(trihydroxysilyl)propyl ester, monohydrochloride (9CI)

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Name

Carbamimidothioic acid,3-(trihydroxysilyl)propyl ester, monohydrochloride (9CI)

EINECS 283-599-3
CAS No. 84682-36-0 Density 1,19 g/cm3
PSA 111.82000 LogP -2.25340
Solubility N/A Melting Point N/A
Formula C7H19ClN2O3SSi Boiling Point N/A
Molecular Weight 274.84 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 84682-36-0 (N-(TRIMETHOXYSILYLPROPYL)ISOTHIO-URONIUM CHLORIDE) Hazard Symbols N/A
Synonyms

N-[(1Z)-amino(sulfanyl)methylidene]-3-(trimethoxysilyl)propan-1-aminium chloride;(Amino{[3-(trimethoxysilyl)propyl]amino}methylen)sulfoniumchlorid;methanethiol, 1-imino-1-[[3-(trimethoxysilyl)propyl]amino]-, hydrochloride (1:1);

 

Carbamimidothioic acid,3-(trihydroxysilyl)propyl ester, monohydrochloride (9CI) Specification

The Carbamimidothioic acid,3-(trihydroxysilyl)propyl ester, monohydrochloride (9CI), with the CAS registry number 84682-36-0 and EINECS registry number 283-599-3, has the systematic name of N-[(1Z)-amino(sulfanyl)methylidene]-3-(trimethoxysilyl)propan-1-aminium chloride. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C7H19ClN2O3SSi.

The characteristics of Carbamimidothioic acid,3-(trihydroxysilyl)propyl ester, monohydrochloride (9CI) are as followings: (1)#H bond acceptors: 5; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 7; (4)Polar Surface Area: 106.48 Å2.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Cl-].CO[Si](CCC\[NH+]=C(\N)S)(OC)OC
(2)InChI: InChI=1/C7H18N2O3SSi.ClH/c1-10-14(11-2,12-3)6-4-5-9-7(8)13;/h4-6H2,1-3H3,(H3,8,9,13);1H
(3)InChIKey: AFVRTALJBDPNPY-UHFFFAOYAW

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