4-[2-(Diethylamino)ethoxy]benzophenone - CAS 796-77-0

Catalog:	BB067111
Product Name:	4-[2-(Diethylamino)ethoxy]benzophenone
CAS:	796-77-0
Synonyms:	[4-[2-(Diethylamino)ethoxy]phenyl]phenyl-methanone; 4-(β-Diethylaminoethoxy)benzophenone

Technical Data

IUPAC Name:	[4-[2-(diethylamino)ethoxy]phenyl]-phenylmethanone
Description:	Used in the preparation of antifertility agents.
Molecular Weight:	297.39
Molecular Formula:	C19H23NO2
Canonical SMILES:	CCN(CC)CCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
InChI:	InChI=1S/C19H23NO2/c1-3-20(4-2)14-15-22-18-12-10-17(11-13-18)19(21)16-8-6-5-7-9-16/h5-13H,3-4,14-15H2,1-2H3
InChI Key:	GSTOOYJSPRJGDO-UHFFFAOYSA-N
Solubility:	Chloroform (Soluble), Dicloromethane (Slightly), Methanol (Sparingly)
Appearance:	Light Yellow to Orange Oil
Storage:	-20°C
References:	Das Gupta, A. et al. Sci. Cult. 38, 480 (1967); Richardson, A. et al. J. Med. Chem. 18, 689 (1975).

Complexity:	313
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	297.172878976
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	297.172878976
Rotatable Bond Count:	8
Topological Polar Surface Area:	29.5Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4