Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 4-methyl-1-(1-methylethyl)-

Einecs 267-755-8 · 1-isopropyl-4-methylbicyclo[2.2.2]oct-5-ene-2-carbaldehyde · 1-Isopropyl-4-methylbicyclo(2.2.2)-5-octene-2-carboxaldehyde · 4-Methyl-1-(1-methylethyl)bicyclo[2.2.2]oct-5-ene-2-carbaldehyde · Bicyclo(2.2.2)oct-5-ene-2-carboxaldehyde, 4-methyl-1-(1-methylethyl)-

https://huagongshe.com/en/chemical/106964

Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 4-methyl-1-(1-methylethyl)- molecular structure

Identifiers & Physical Properties

CAS No.	36208-34-1
Molecular formula	C13H20O
Average molar mass	192.3 g/mol
Monoisotopic mass	192.15141526 g/mol
SMILES	CC(C)C12C=CC(C)(CC1)CC2C=O
InChIKey	PDSPBIIMJJPMBL-UHFFFAOYSA-N
PubChem CID	106964
EC No.	267-755-8
DTXSID	DTXSID50867403

Chemical & Physical Properties

XLogP	3.5
Topological polar surface area	17.1
Hydrogen bond donors	0
Hydrogen bond acceptors	1
Rotatable bonds	2
Heavy atoms	14
Formal charge	0
Complexity	279
Boiling point	246.2±29.0 °C(Predicted)
Density	1.042±0.06 g/cm3(Predicted)
Cosmetics Ingredients Functions	PERFUMING
LogP (partition coefficient)	3.571 (est)
EPA Substance Registry System	Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 4-methyl-1-(1-methylethyl)- (67920-94-9)
TSCA inventory status	TSCA listed

Safety & Regulations

Regulatory information	Chemical: Bicyclo[2.2.2]oct-5-ene-2-carboxaldehyde, 4-methyl-1-(1-methylethyl)-
TSCA inventory status	TSCA listed