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Calcipotriol Impurity 4
[CAS# 126860-84-2]

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Identification
NameCalcipotriol Impurity 4
Synonyms(4R)-4-[(1R,3aS,4E,7aR)-4-[(2E)-2-[(3S,5R)-3,5-dihydroxy-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-1-cyclopropylpentan-1-one
Molecular StructureCAS # 126860-84-2, Calcipotriol Impurity 4
Molecular FormulaC27H40O3
Molecular Weight412.60
CAS Registry Number126860-84-2
SMILESC[C@H](CCC(=O)C1CC1)[C@H]2CC[C@@H]3[C@@]2(CCC/C3=CC=C4/C[C@H](C[C@@H](C4=C)O)O)C
Properties
Density1.1±0.1 g/cm3, Calc.*
Index of Refraction1.562, Calc.*
Boiling Point574.2±50.0 °C (760 mmHg), Calc.*
Flash Point315.1±26.6 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbolssymbol   GHS07 Warning  Details
Risk StatementsH302+H312+H332-H315-H319  Details
Safety StatementsP261-P271-P280-P302+P352-P305+P351+P338  Details
SDSAvailable
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