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205503-61-3 molecular structure
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[bis(tert-butylamino)silyl](tert-butyl)amine

ChemBase ID: 151008
Molecular Formular: C12H31N3Si
Molecular Mass: 245.48014
Monoisotopic Mass: 245.22872454
SMILES and InChIs

SMILES:
CC(C)(C)N[SiH](NC(C)(C)C)NC(C)(C)C
Canonical SMILES:
CC(N[SiH](NC(C)(C)C)NC(C)(C)C)(C)C
InChI:
InChI=1S/C12H31N3Si/c1-10(2,3)13-16(14-11(4,5)6)15-12(7,8)9/h13-16H,1-9H3
InChIKey:
UGJHADISJBNSFP-UHFFFAOYSA-N

Cite this record

CBID:151008 http://www.chembase.cn/molecule-151008.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
[bis(tert-butylamino)silyl](tert-butyl)amine
IUPAC Traditional name
[bis(tert-butylamino)silyl](tert-butyl)amine
Synonyms
N,N′,N′′-Tri-tert-butylsilanetriamine
N,N′,N′′-三叔丁基硅烷三胺
CAS Number
205503-61-3
MDL Number
MFCD02683517
PubChem SID
162245167
24871121
PubChem CID
45052065

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
475386 external link Add to cart Please log in.
Data Source Data ID
PubChem 45052065 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -7.6524024  LogD (pH = 7.4) -4.6250567 
Log P 1.3485  Molar Refractivity 101.0516 cm3
Polarizability 30.37188 Å3 Polar Surface Area 36.09 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
76-80 °C/0.3 mmHg(lit.) expand Show data source
Flash Point
127.4 °F expand Show data source
53 °C expand Show data source
Density
0.827 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.4289(lit.) expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
1760 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
10-34 expand Show data source
Safety Statements
16-26-36/37/39-45 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H226-H314 expand Show data source
GHS Precautionary statements
P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 1760 8/PG 2 expand Show data source
Purity
99.99% trace metals basis expand Show data source
Linear Formula
HSi(HNC(CH3)3)3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 475386 external link
Packaging
5, 10 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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