5-bromo-2-(2-methoxyethoxy)aniline hydrochloride

5-bromo-2-(2-methoxyethoxy)aniline hydrochloride

CAS: 1185300-88-2

Formula: C9H13BrClNO2

SMILES: Cl.COCCOC1=C(N)C=C(Br)C=C1

IUPAC: 5-bromo-2-(2-methoxyethoxy)aniline hydrochloride

InChI: InChI=1S/C9H12BrNO2.ClH/c1-12-4-5-13-9-3-2-7(10)6-8(9)11;/h2-3,6H,4-5,11H2,1H3;1H

Composition: C (38.26%), H (4.64%), Br (28.28%), Cl (12.55%), N (4.96%), O (11.32%)

Molar Mass: 282.56

Atom Count: 27

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	280.981819
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	JGRGRSCSRKXBBH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.89
Topological Polar Surface Area	44.48
Polarizability	21.21
Ring Count	1
Rotatable Bond Count	4

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