5-bromo-2-[2-(diethylamino)ethoxy]aniline

5-bromo-2-[2-(diethylamino)ethoxy]aniline

CAS: 946699-87-2

Formula: C12H19BrN2O

SMILES: CCN(CC)CCOC1=C(N)C=C(Br)C=C1

IUPAC: 5-bromo-2-[2-(diethylamino)ethoxy]aniline

InChI: InChI=1S/C12H19BrN2O/c1-3-15(4-2)7-8-16-12-6-5-10(13)9-11(12)14/h5-6,9H,3-4,7-8,14H2,1-2H3

Composition: C (50.19%), H (6.67%), Br (27.82%), N (9.75%), O (5.57%)

Molar Mass: 287.201

Atom Count: 35

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	286.068076
Formal Charge	0
FSP3	0.5
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	TUGAAQZVRIFANA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.36
Topological Polar Surface Area	38.49
Polarizability	27.45
Ring Count	1
Rotatable Bond Count	6

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