[4(S)-[trans(trans)]]-1,3-Difluoro-2-[(1-methylheptyl)oxy]-5-(4'-propyl[1,1'-bicyclohexyl]-4-yl)benzene | CAS No. 185207-90-3

[4(S)-[trans(trans)]]-1,3-Difluoro-2-[(1-methylheptyl)oxy]-5-(4'-propyl[1,1'-bicyclohexyl]-4-yl)benzene

Basic Information

CAS Number

185207-90-3

Molecular Formula

C29H46F2O

Molecular Weight

448.67 g/mol

AD

Basic Physical Properties

Boiling Point

506.9±50.0 °C(Predicted)

Density

0.990±0.06 g/cm3(Predicted)

Solubility

Insuluble (1.9E-7 g/L) (25 ºC),

FC1C(=C(C=C(C=1)C1CCC(CC1)C1CCC(CCC)CC1)F)O[C@@H](C)CCCCCC

InChI

1S/C29H46F2O/c1-4-6-7-8-10-21(3)32-29-27(30)19-26(20-28(29)31)25-17-15-24(16-18-25)23-13-11-22(9-5-2)12-14-23/h19-25H,4-18H2,1-3H3/t21-,22?,23?,24?,25?/m0/s1

InChIKey

VDXVHNIYCHTFIC-LTHPYGAZSA-N

LogP

9.582799999999997

Topological Polar Surface Area

9.23 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

483

Synonyms & References

English

  • [4(S)-[trans(trans)]]-1,3-Difluoro-2-[(1-methylheptyl)oxy]-5-(4'-propyl[1,1'-bicyclohexyl]-4-yl)benzene
  • S2011
  • Benzene, 1,3-difluoro-2-[[(1S)-1-methylheptyl]oxy]-5-[(trans,trans)-4'-propyl[1,1'-bicyclohexyl]-4-yl]-
  • [4(S)-[trans(trans)]]-1,3-Difluoro-2-[(1-methylheptyl)oxy]-5-(4'-propyl[1,1'-bicyclohexyl]-4-yl)benzene(Chiral Dopant S2011)
  • S2011 Left
  • 1,3-Difluoro-2-[(2S)-octan-2-yl]oxy-5-[4-(4-propylcyclohexyl)cyclohexyl]benzene
  • (trans,trans)-4-(3,5-Difluoro-4-((S)-octan-2-yloxy)phenyl)-4'-propyl-1,1'-bi(cyclohexane)
  • (1S,1's,4S,4'R)-4-(3,5-difluoro-4-(octan-2-yloxy)phenyl)-4'-propyl-1,1'-bi(cyclohexane)
  • 4-[3,5-Difluoro-4-[(S)-1-methylheptyloxy]phenyl]-4'-propyl-1,1'-bicyclohexane
  • 1,3-difluoro-2-[[(1S)-1-methylheptyl]oxy]-5-[(trans,trans)-4'-propyl[1,1'-bicyclohexyl]-4-yl]-Benzene
  • (trans,trans)-4-(3,5-difluoro-4-((S)-octan-2-yloxy)phenyl)-4'-propyl-1,1'-bi(cyclohexane)
  • CID 67751609

MDL Number

MFCD26143183

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