Cinmethylin | CAS No. 87818-31-3

Cinmethylin

Basic Information

CAS Number

87818-31-3

Molecular Formula

C18H26O2

Molecular Weight

274.4 g/mol

AD

Basic Physical Properties

Melting Point

25°C

Boiling Point

313 ºC

Density

d20 1015 kg/m3

Refractive Index

1.4800 (estimate)

CC(C)[C@@]1(CC[C@]2(C)O1)C[C@H]2OCc3ccccc3C

InChI

InChI=1S/C18H26O2/c1-13(2)18-10-9-17(4,20-18)16(11-18)19-12-15-8-6-5-7-14(15)3/h5-8,13,16H,9-12H2,1-4H3/t16-,17+,18-/m1/s1

InChIKey

QMTNOLKHSWIQBE-FGTMMUONSA-N

LogP

4.2478200000000035

Topological Polar Surface Area

18.46 Ų

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

353

Safety Information

View Safety Information

Hazard Statement

H332 Harmful if inhaled
Acute toxicity, inhalation
H411 Toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Toxicity

LD50 orally in rats: 4.5 g/kg; LD50 dermally in rabbits: >2 g/kg (Lee)

Synonyms & References

English

  • Cinmethylin
  • 1-Methyl-4-(1-methylethyl)-2-((2-methylphenyl)methoxy)-7-oxabicyclo[2.2.1]heptane
  • (1R,2S,4S)-rel-1-methyl-4-(1-methylethyl)-2-[(2-methylphenyl)methoxy]-7-oxabicyclo[2.2.1]heptane
  • (1RS,2SR,4SR)-1,4-epoxy-p-menth-2-yl 2-methylbenzyl ether
  • (2.2.1)heptane
  • argold
  • cinch
  • Cinmethylin [iso]
  • exo-(+-)-xy)
  • SKH 301
  • 7-Oxabicyclo[2.2.1]heptane, 1-methyl-4-(1-methylethyl)-2-[(2-methylphenyl)methoxy]-, exo-(±)- (ZCI)
  • rel-(1R,2S,4S)-1-Methyl-4-(1-methylethyl)-2-[(2-methylphenyl)methoxy]-7-oxabicyclo[2.2.1]heptane (ACI)
  • (±)-2-exo-(2-Methylbenzyloxy)-1-methyl-4-isopropyl-7-oxabicyclo[2.2.1]heptane
  • 7-Oxabicyclo[2.2.1]heptane, 1-methyl-4-(1-methylethyl)-2-[(2-methylphenyl)methoxy]-, exo-
  • Cinch
  • SD 95481

MDL Number

MFCD01632785

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