CAS Registry Number®
80-54-6
CAS Name
Lilial
Molecular Formula
C14H20O
Molecular Mass
204.31
Compound Properties
-
Boiling Point (1)
95-96 °C @ Press: 1 Torr
-
Melting Point (2)
106-109 °C
-
Density (1)
0.942 g/cm³ @ Temp: 25 °C
Source(s)
- (1) GB798901, 1958, CAplus
- (2) Taber, Douglass F.; Journal of Organic Chemistry, (2008), 73(20), 8030-8032, CAplus
Other Names and Identifiers
InChI
InChI=1S/C14H20O/c1-11(10-15)9-12-5-7-13(8-6-12)14(2,3)4/h5-8,10-11H,9H2,1-4H3
InChIKey
InChIKey=SDQFDHOLCGWZPU-UHFFFAOYSA-N
SMILES
C(C)(C)(C)C1=CC=C(CC(C=O)C)C=C1
Canonical SMILES
O=CC(C)CC1=CC=C(C=C1)C(C)(C)C
Other Names for this Substance
- Benzenepropanal, 4-(1,1-dimethylethyl)-α-methyl-
- Hydrocinnamaldehyde, p–tert-butyl-α-methyl-
- 4-(1,1-Dimethylethyl)-α-methylbenzenepropanal
- p–tert-Butyl-α-methylhydrocinnamaldehyde
- Lilial
- α-Methyl-p–tert-butylhydrocinnamaldehyde
- 3-(4-tert-Butylphenyl)-2-methylpropanal
- 3-(p–tert-Butylphenyl)isobutylaldehyde
- 3-(p–tert-Butylphenyl)-2-methylpropionaldehyde
- p–tert-Butyl-α-methylhydrocinnamic aldehyde
- 4-tert-Butyl-α-methylhydrocinnamic aldehyde
- (±)-2-Methyl-3-(4-tert-butylphenyl)propanal
- PT-Bucinal
- NSC 22275
- Lilestralis
- 2-Methyl-3-(4-tert-butylphenyl)propanal
- 2-[(4-tert-Butylphenyl)methyl]propanal
- β-Lilial
- Lysmeral
- lilestral
- Lysmeral Extra
- p–tert-Butyl-α-methyldihydrocinnamaldehyde
- 2-Methyl-3-(p–tert-butylphenyl)propanal
- 2-(4-tert-Butylbenzyl)propanal
- 2-(4-tert-Butylbenzyl)propionaldehyde
- P-T-Bucinal
- Butylphenyl methylpropional
Deleted or Replaced CAS Registry Numbers
39390-70-0, 75166-25-5
