3-(4-bromophenyl)prop-2-en-1-amine hydrochloride

3-(4-bromophenyl)prop-2-en-1-amine hydrochloride

Formula: C9H11BrClN

SMILES: Cl.NCC=CC1=CC=C(Br)C=C1

IUPAC: 3-(4-bromophenyl)prop-2-en-1-amine hydrochloride

InChI: InChI=1S/C9H10BrN.ClH/c10-9-5-3-8(4-6-9)2-1-7-11;/h1-6H,7,11H2;1H

Composition: C (43.49%), H (4.46%), Br (32.15%), Cl (14.26%), N (5.64%)

Molar Mass: 248.55

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	246.97634
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	UTROOURKHTUDDG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.47
Topological Polar Surface Area	26.02
Polarizability	19.83
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H11BrClN		Quote Only