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Methyl 3,3-dimethoxy-2-oxa-7,10-diaza-3-silatridecan-13-oate

HCID 70602
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1067-66-9
Standard SMILES
COC(=O)CCNCCNCCC[Si](OC)(OC)OC
InChIKey
IKUCSZCOPRPNOY-UHFFFAOYSA-N
Molecular formula
C12H28N2O5Si
Average molar mass
308.45 g/mol
Monoisotopic mass
308.17674853

Names & identifiers

Preferred name
Methyl 3,3-dimethoxy-2-oxa-7,10-diaza-3-silatridecan-13-oate
IUPAC
methyl 3-[2-(3-trimethoxysilylpropylamino)ethylamino]propanoate
English name
Methyl[2-(3-trimethoxysilylpropylamino)ethylamino]-3-propionate
Molecular formula
C12H28N2O5Si
Molecular weight
308.45

Names & synonyms

2-Oxa-7,10-diaza-3-silatridecan-13-oic acid, 3,3-dimethoxy-, methyl esterMethyl 3,3-dimethoxy-2-oxa-7,10-diaza-3-silatridecan-13-oateDTXSID106144312-Oxa-4,7-diaza-11-silatridecanoic acid, 11,11-dimethoxy-, methyl esterMethyl 11,11-dimethoxy-12-oxa-4,7-diaza-11-silatridecanoateRefChem:814632DTXCID2033023213-937-71067-66-9methyl 3-[2-(3-trimethoxysilylpropylamino)ethylamino]propanoateA-1125 (silane)EINECS 213-937-7
Show more names
c600DK46570%inmethanola-1125(silane)MethyltrimethoxysilylpropylaminoethylaminoMETHYL[2-(3-TRIMETHOXYSILYLPROPYLAMINO)-ETHYLAMINO]methyl 3,3-dimethoxy-2-oxa-7,10-diaza-3-silatridecanoatemethyl3,3-dimethoxy-2-oxa-7,10-diaza-3-silatridecan-13-oate
IKUCSZCOPRPNOY-UHFFFAOYSA-NMethyl[2-(3-trimethoxysilylpropylamino)ethylamino]-3-propionatebeta-Alanine, N-(2-((3-(trimethoxysilyl)propyl)amino)ethyl)-, methyl esterURT4H9S8Z7SCHEMBL9515366NS00043192Methyl N-(2-{[3-(trimethoxysilyl)propyl]amino}ethyl)-beta-alaninate

Properties

Computed structural properties

Topological polar surface area
78.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
14
Heavy atoms
20
Formal charge
0
Complexity
244

Physicochemical properties

Boiling point
348.5 · 348.5±32.0 °C(Predicted)
Density
1 · 1,01 g/cm3
Flash point
32 °C · 32°C
pka
10.11 · 10.11±0.19(Predicted)
EPA Substance Registry System
2 · 2-Oxa-7,10-diaza-3-silatridecan-13-oic acid, 3,3-dimethoxy-, methyl ester (1067-66-9)
Risk Statements
11 · 11-23/25
Safety Statements
2 · 2-7-16-24
RIDADR
1760 · 1760
TSCA
TSCA listed
HazardClass
8 · 8
PackingGroup
III

Safety & regulation

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

GHS classification

GHS Classification · 3 items

This chemical does not meet GHS hazard criteria for 100% (26 of 26) of all reports.

Not Classified

Aggregated GHS information provided per 26 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Regulatory InformationChemical: 2-Oxa-7,10-diaza-3-silatridecan-13-oic acid, 3,3-dimethoxy-, methyl ester
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed
ridadr
1760
risk_code
11-23/25
safety_code
2-7-16-24
hazard_class
8
packing_group
III

Chemistry & industry

Uses & manufacturing

General Manufacturing Information12-Oxa-4,7-diaza-11-silatridecanoic acid, 11,11-dimethoxy-, methyl ester: ACTIVE

Suppliers2 total

陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
1067-66-9
PubChem CID
70602
DTXSID
DTXSID1061443
UNII
URT4H9S8Z7
EC Number
213-937-7
Nikkaji
J217.176G