4-Tolualbenzaldehyde

CAS	104-87-0
Structure
Synonyms	p-Tolualdehyde
IUPAC Name	4-Methylbenzaldehyde
Molecular Weight	120.15
Canonical SMILES	CC1=CC=C(C=C1)C=O
InChI	InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3
InChI Key	FXLOVSHXALFLKQ-UHFFFAOYSA-N
Boiling Point	204-205 °C
Melting Point	-6 °C
Flash Point	176 °F
Purity	95%+
Density	1.019 g/mL at 25 °C(lit.)
Solubility	Miscible with ethanol, ethyl ether, acetone; very soluble in chloroform
Exact Mass	120.057514874
Monoisotopic Mass	120.057514874
Odor	Floral odor
Physical State	Liquid
Refractive Index	n20/D 1.545(lit.)
Storage Conditions	Below +30 °C
Topological Polar Surface Area	17.1 Ų