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Home >> Chemical Listing >> Page 1626 >> 3-[(1R,2R)-2-Isopropyl-1-Methyl-5-Oxocyclopentyl]Propanenitrile

3-[(1R,2R)-2-Isopropyl-1-Methyl-5-Oxocyclopentyl]Propanenitrile
[CAS# 479578-37-5]

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Identification
Name 3-[(1R,2R)-2-Isopropyl-1-Methyl-5-Oxocyclopentyl]Propanenitrile
Synonyms 3-((1R,2R)-2-isopropyl-1-methyl-5-oxocyclopentyl)propanenitrile
Molecular Structure CAS#: 479578-37-5, 3-[(1R,2R)-2-Isopropyl-1-Methyl-5-Oxocyclopentyl]Propanenitrile
Molecular Formula C12H19NO
Molecular Weight 193.29
CAS Registry Number 479578-37-5
SMILES O=C1CC[C@H](C(C)C)[C@]1(CCC#N)C
InChI 1S/C12H19NO/c1-9(2)10-5-6-11(14)12(10,3)7-4-8-13/h9-10H,4-7H2,1-3H3/t10-,12-/m1/s1
InChIKey WJIZUTGQUOXXHB-ZYHUDNBSSA-N
Properties
Density 0.951g/cm3 (Cal.)
Boiling point 311.566°C at 760 mmHg (Cal.)
Flash point 142.23°C (Cal.)
Refractive index 1.458 (Cal.)
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