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162224807 molecular structure
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dioxo-2,4-dioxa-3-sila-1,5-dialuminapentan-3-one

ChemBase ID: 130528
Molecular Formular: Al2H2O5Si
Molecular Mass: 164.061456
Monoisotopic Mass: 163.93022696
SMILES and InChIs

SMILES:
O=[AlH]O[Si](=O)O[AlH]=O
Canonical SMILES:
O=[AlH]O[Si](=O)O[AlH]=O
InChI:
InChI=1S/2Al.O3Si.2O/c;;1-4(2)3;;/q2*+1;-2;;
InChIKey:
PZZYQPZGQPZBDN-UHFFFAOYSA-N

Cite this record

CBID:130528 http://www.chembase.cn/molecule-130528.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dioxo-2,4-dioxa-3-sila-1,5-dialuminapentan-3-one
IUPAC Traditional name
aluminium silicate
Synonyms
Aluminium silicate
PubChem SID
162224807
PubChem CID
16703273
10313254
Chemspider ID
8488719
Wikipedia Title
Aluminium_silicate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.4332  LogD (pH = 7.4) 2.4332 
Log P 2.4332  Molar Refractivity 7.0291 cm3
Polarizability 10.280346 Å3 Polar Surface Area 69.67 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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