3-bromo-5-chloro-4-ethoxyaniline

3-bromo-5-chloro-4-ethoxyaniline

CAS: 1255574-73-2

Formula: C8H9BrClNO

SMILES: CCOC1=C(Cl)C=C(N)C=C1Br

IUPAC: 3-bromo-5-chloro-4-ethoxyaniline

InChI: InChI=1S/C8H9BrClNO/c1-2-12-8-6(9)3-5(11)4-7(8)10/h3-4H,2,11H2,1H3

Composition: C (38.36%), H (3.62%), Br (31.90%), Cl (14.15%), N (5.59%), O (6.39%)

Molar Mass: 250.52

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	248.955605
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	TYMMOOOPQRQWOH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.4
Topological Polar Surface Area	35.25
Polarizability	20.63
Ring Count	1
Rotatable Bond Count	2

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