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Calcium Bis(Dibromodocosanoate)
[CAS# 1301-35-5]

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CAS#: 1301-35-5
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Identification
Name Calcium Bis(Dibromodocosanoate)
Synonyms Calcium 13,14-Dibromobehenic Acid; Calcium Bis(Dibromodocosanoate)
Molecular Structure CAS#: 1301-35-5, Calcium Bis(Dibromodocosanoate)
Molecular Formula C22H42Br2CaO2
Molecular Weight 538.46
CAS Registry Number 1301-35-5
EINECS 215-096-1
SMILES C(C)CCCCCCC(Br)C(Br)CCCCCCCCCCCC(O)=O.[Ca++]
InChI 1S/C22H42Br2O2.Ca/c1-2-3-4-5-11-14-17-20(23)21(24)18-15-12-9-7-6-8-10-13-16-19-22(25)26;/h20-21H,2-19H2,1H3,(H,25,26);/q;+2
InChIKey JLVDYABJSVOBQD-UHFFFAOYSA-N
Properties
Boiling point 532.1°C at 760 mmHg (Cal.)
Flash point 275.6°C (Cal.)
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