2-ethylhexyl 4-(methylamino)benzoate

2-ethylhexyl 4-(methylamino)benzoate

CAS: 158576-31-9

Formula: C16H25NO2

SMILES: CCCCC(CC)COC(=O)C1=CC=C(NC)C=C1

IUPAC: 2-ethylhexyl 4-(methylamino)benzoate

InChI: InChI=1/C16H25NO2/c1-4-6-7-13(5-2)12-19-16(18)14-8-10-15(17-3)11-9-14/h8-11,13,17H,4-7,12H2,1-3H3

Composition: C (72.97%), H (9.57%), N (5.32%), O (12.15%)

Molar Mass: 263.381

Atom Count: 44

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	263.188529049
Formal Charge	0
FSP3	0.56
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	BJNUBFKLXPUYKI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.43
Topological Polar Surface Area	38.33
Polarizability	30.62
Ring Count	1
Rotatable Bond Count	9

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