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2-Phenyl-2-Pentenal
[CAS# 3491-63-2]

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Identification
Name 2-Phenyl-2-Pentenal
Synonyms 2-Phenyl-2-Pentenal; Benzeneacetaldehyde, Alpha-Propylidene-; Zinc02510135
Molecular Structure CAS#: 3491-63-2, 2-Phenyl-2-Pentenal
Molecular Formula C11H12O
Molecular Weight 160.22
CAS Registry Number 3491-63-2
SMILES C1=CC=CC=C1\C(=C/CC)C=O
InChI 1S/C11H12O/c1-2-6-11(9-12)10-7-4-3-5-8-10/h3-9H,2H2,1H3/b11-6-
InChIKey YPAJRUMMODCONM-WDZFZDKYSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
1.005 (Expl.)
Boiling point 124-126°C (Expl.)
286.7±10.0°C at 760 mmHg (Cal.)
Flash point 100°C (Expl.)
106.2±14.3°C (Cal.)
Refractive index 1.551 (Expl.)
Safety Data
Safety Code S26;S37  Details
Risk Code R36/37/38  Details
Hazard Symbol symbol  X  Details
Safety Description WARNING: Irritates lungs, eyes, skin
SDS Available
References
(1) Arceo et al.. Photochemical activity of a key donor-acceptor complex can drive stereoselective catalytic alpha-alkylation of aldehydes, Nature Chemistry, 2013
Market Analysis Reports
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