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Calcium 4-Nitrophenolate
[CAS# 34005-60-2]

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CAS#: 34005-60-2
Product: Calcium 4-Nitrophenolate
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Identification
Name Calcium 4-Nitrophenolate
Synonyms Phenol, P-Nitro-, Calcium Salt; P-Nitrophenol Calcium Salt
Molecular Structure CAS#: 34005-60-2, Calcium 4-Nitrophenolate
Molecular Formula C12H8CaN2O6
Molecular Weight 316.29
CAS Registry Number 34005-60-2
SMILES C1=C([N+](=O)[O-])C=CC(=C1)[O-].C2=C([N+]([O-])=O)C=CC(=C2)[O-].[Ca++]
InChI 1S/2C6H5NO3.Ca/c2*8-6-3-1-5(2-4-6)7(9)10;/h2*1-4,8H;/q;;+2/p-2
InChIKey IELLGWCBQATIRX-UHFFFAOYSA-L
Properties
Boiling point 279°C at 760 mmHg (Cal.)
Flash point 141.9°C (Cal.)
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