diethylamino hydroxybenzoyl hexyl benzoate

diethylamino hydroxybenzoyl hexyl benzoate

CAS: 302776-68-7

Formula: C24H31NO4

SMILES: CCCCCCOC(=O)C1=C(C=CC=C1)C(=O)C1=C(O)C=C(C=C1)N(CC)CC

IUPAC: hexyl 2-[4-(diethylamino)-2-hydroxybenzoyl]benzoate

InChI: InChI=1S/C24H31NO4/c1-4-7-8-11-16-29-24(28)20-13-10-9-12-19(20)23(27)21-15-14-18(17-22(21)26)25(5-2)6-3/h9-10,12-15,17,26H,4-8,11,16H2,1-3H3

Composition: C (72.52%), H (7.86%), N (3.52%), O (16.10%)

Molar Mass: 397.515

Atom Count: 60

Heavy Atom Count: 29

Properties

Properties

Common Names	diethylamino hydroxybenzoyl hexyl benzoate
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	397.225308482
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	FDATWRLUYRHCJE-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	117.64
Topological Polar Surface Area	66.84
Polarizability	44.72
Ring Count	2
Rotatable Bond Count	12

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