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BENZOIN ISOPROPYL ETHER

Catalog Number ACM6652284-1
CAS 6652-28-4
Structure {[CurrentData.Name]}
IUPAC Name 1,2-diphenyl-2-propan-2-yloxyethanone
Molecular Weight 254.32400
Molecular Formula C17H18O2
Canonical SMILES CC(C)OC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
InChI InChI=1S/C17H18O2/c1-13(2)19-17(15-11-7-4-8-12-15)16(18)14-9-5-3-6-10-14/h3-13,17H,1-2H3
InChI Key MSAHTMIQULFMRG-UHFFFAOYSA-N
Melting Point 78-80 °C(lit.)
Flash Point 152.1ºC
Density 1.065 g/cm3
Complexity 273
Covalently-Bonded Unit Count 1
EC Number 229-677-2
Exact Mass 254.13100
Heavy Atom Count 19
Log P 4.03560
Monoisotopic Mass 254.13068g/mol
PSA 26.30000
Rotatable Bond Count 5
X Log P3 3.5
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