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302912-46-5 molecular structure
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N,1,3-tri-tert-butyl-1,3,2,4-diazadisiletidin-2-amine

ChemBase ID: 145577
Molecular Formular: C12H31N3Si2
Molecular Mass: 273.56564
Monoisotopic Mass: 273.20565107
SMILES and InChIs

SMILES:
CC(C)(C)N[SiH]1N([SiH2]N1C(C)(C)C)C(C)(C)C
Canonical SMILES:
CC(N[SiH]1N([SiH2]N1C(C)(C)C)C(C)(C)C)(C)C
InChI:
InChI=1S/C12H31N3Si2/c1-10(2,3)13-17-14(11(4,5)6)16-15(17)12(7,8)9/h13,17H,16H2,1-9H3
InChIKey:
FSPDMYLRXNXGAH-UHFFFAOYSA-N

Cite this record

CBID:145577 http://www.chembase.cn/molecule-145577.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N,1,3-tri-tert-butyl-1,3,2,4-diazadisiletidin-2-amine
IUPAC Traditional name
N,1,3-tri-tert-butyl-1,3,2,4-diazadisiletidin-2-amine
Synonyms
1,3-Di-tert-butyl-2-(tert-butylamino)-1,3-diaza-2,4-disilacyclotetrane
1,3-二叔丁基-2-叔丁基氨基-1,3-二氮杂-2,4-二硅杂环四烷
CAS Number
302912-46-5
MDL Number
MFCD02683494
PubChem SID
24874614
162239782
PubChem CID
16213845

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
527262 external link Add to cart Please log in.
Data Source Data ID
PubChem 16213845 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -4.7328434  LogD (pH = 7.4) -2.843441 
Log P 1.4891  Molar Refractivity 80.8236 cm3
Polarizability 32.557053 Å3 Polar Surface Area 18.51 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
92-95 °C/0.3 mmHg(lit.) expand Show data source
Flash Point
188.6 °F expand Show data source
87 °C expand Show data source
Density
0.88 g/mL at 25 °C(lit.) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
Purity
95% expand Show data source
Empirical Formula (Hill Notation)
C12H31N3Si2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 527262 external link
Packaging
1 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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