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84682-36-0

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Basic Information
CAS No.: 84682-36-0
Name: N-(TRIMETHOXYSILYLPROPYL)ISOTHIO-URONIUM CHLORIDE
Molecular Structure:
Molecular Structure of 84682-36-0 (N-(TRIMETHOXYSILYLPROPYL)ISOTHIO-URONIUM CHLORIDE)
Formula: C7H19ClN2O3SSi
Molecular Weight: 274.84
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);
EINECS: 283-599-3
Density: 1,19 g/cm3
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 111.82000
LogP: -2.25340
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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