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12027-67-7 molecular structure
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tris(dioxomolybdenumdiol) tetrakis(trioxomolybdenum) hexaamine

ChemBase ID: 103411
Molecular Formular: H24Mo7N6O24
Molecular Mass: 1163.93636
Monoisotopic Mass: 1177.42205168
SMILES and InChIs

SMILES:
N.N.N.N.N.N.O[Mo](=O)(=O)O.O[Mo](=O)(=O)O.O[Mo](=O)(=O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O
Canonical SMILES:
O[Mo](=O)(=O)O.O[Mo](=O)(=O)O.O[Mo](=O)(=O)O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.O=[Mo](=O)=O.N.N.N.N.N.N
InChI:
InChI=1S/7Mo.6H3N.6H2O.18O/h;;;;;;;6*1H3;6*1H2;;;;;;;;;;;;;;;;;;/q;;;;3*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-6
InChIKey:
PTPRBYUXSYJORU-UHFFFAOYSA-H

Cite this record

CBID:103411 http://www.chembase.cn/molecule-103411.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tris(dioxomolybdenumdiol) tetrakis(trioxomolybdenum) hexaamine
IUPAC Traditional name
tetrakis(molybdenum trioxide) tris(molybdic acid) hexaamine
Synonyms
MOLYBDIC ACID
MOLYBDIC ACID AMMONIUM SALT
CAS Number
12027-67-7
EC Number
234-722-4
PubChem SID
162091306
PubChem CID
44134832

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 44134832 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 12.076221  H Acceptors
H Donor LogD (pH = 5.5) -1.7752001 
LogD (pH = 7.4) -1.7752091  Log P -1.7752 
Molar Refractivity 8.015 cm3 Polarizability 8.019182 Å3
Polar Surface Area 74.6 Å2 Rotatable Bonds
Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Condition
Room Temperature (15-30°C) expand Show data source
RTECS
QA5076000 expand Show data source
European Hazard Symbols
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Risk Statements
R:40-20/21/22 expand Show data source
Safety Statements
S:20-26-45-36/37/39 expand Show data source
Certificate of Analysis
Download expand Show data source
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 02151704 external link
Ammonium Salt
MP Biomedicals - 02194710 external link
Ammonium Salt
Cell Culture Reagent

REFERENCES

REFERENCES

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PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

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