2-(3-amino-4-bromophenoxy)-N-methylacetamide

2-(3-amino-4-bromophenoxy)-N-methylacetamide

CAS: 1387566-08-6

Formula: C9H11BrN2O2

SMILES: CNC(=O)COC1=CC=C(Br)C(N)=C1

IUPAC: 2-(3-amino-4-bromophenoxy)-N-methylacetamide

InChI: InChI=1S/C9H11BrN2O2/c1-12-9(13)5-14-6-2-3-7(10)8(11)4-6/h2-4H,5,11H2,1H3,(H,12,13)

Composition: C (41.72%), H (4.28%), Br (30.84%), N (10.81%), O (12.35%)

Molar Mass: 259.103

Atom Count: 25

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	258.000391
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	DHBLRGZPKYKVPL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.65
Topological Polar Surface Area	64.35
Polarizability	21.79
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1387566-08-6		$68.09-$303.90$68.09$113.49$303.90