CAS Registry Number®
16251-77-7
CAS Name
3-Phenylbutanal
Molecular Formula
C10H12O
Molecular Mass
148.20
Compound Properties
-
Boiling Point (1)
110 °C @ Press: 9 Torr
-
Density (2)
1.059 g/cm³ @ Temp: 20 °C
Source(s)
- (1) v. Braun, J.; Berichte der Deutschen Chemischen Gesellschaft, (1913), 46, 1266-82, CAplus
- (2) Vartanyan, S. A.; Armyanskii Khimicheskii Zhurnal, (1967), 20(4), 325-7, CAplus
Other Names and Identifiers
InChI
InChI=1S/C10H12O/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3
InChIKey
InChIKey=MYHGOWDLVRDUFA-UHFFFAOYSA-N
SMILES
C(CC=O)(C)C1=CC=CC=C1
Canonical SMILES
O=CCC(C=1C=CC=CC1)C
Other Names for this Substance
- Benzenepropanal, β-methyl-
- Hydrocinnamaldehyde, β-methyl-
- β-Methylbenzenepropanal
- 3-Phenylbutanal
- 3-Phenylbutyraldehyde
- (RS)-3-Phenylbutanal
- (±)-3-Phenylbutyraldehyde
- Trifernal
- 3-Methyl-3-phenylpropionaldehyde
- 3-Phenylbutylaldehyde
- 3-Phenyl-1-butanal
Deleted or Replaced CAS Registry Numbers
108211-22-9, 65885-41-8
