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Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride

HCID 94087
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Basic information

CAS
58505-58-1
Standard SMILES
CO[Si](CCCSC(=N)N)(OC)OC.Cl
InChIKey
BCZMKSMVRLGRFS-UHFFFAOYSA-N
Molecular formula
C7H18N2O3SSi.ClH
Average molar mass
274.84 g/mol
Monoisotopic mass
274.0574179

Names & identifiers

Preferred name
Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride
IUPAC
3-trimethoxysilylpropyl carbamimidothioate;hydrochloride

Names & synonyms

Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochlorideCarbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, hydrochloride (1:1)DTXSID9069263RefChem:574070DTXCID904241158505-58-1Trimethoxysilylpropylisothiouronium chlorideEINECS 261-297-2C7H19ClN2O3SSiSCHEMBL29405755BCZMKSMVRLGRFS-UHFFFAOYSA-N2-(3-(Trimethoxysilyl)propyl)isothiouronium chloride
Show more names
2-(3-trimethoxysilylpropyl)isothiourea;hydrochloride3-trimethoxysilylpropyl carbamimidothioate;hydrochloride

Database identifiers

CAS
58505-58-1
PubChem CID
94087
EC Number
261-297-2

Properties

Computed structural properties

Topological polar surface area
103 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
15
Formal charge
0
Complexity
170

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationChemical: Carbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, monohydrochloride
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationCarbamimidothioic acid, 3-(trimethoxysilyl)propyl ester, hydrochloride (1:1): INACTIVE

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Compound notes

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