N1-(3-bromophenyl)ethane-1,2-diamine

N1-(3-bromophenyl)ethane-1,2-diamine

CAS: 14088-81-4

Formula: C8H11BrN2

SMILES: NCCNC1=CC(Br)=CC=C1

IUPAC: N1-(3-bromophenyl)ethane-1,2-diamine

InChI: InChI=1S/C8H11BrN2/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6,11H,4-5,10H2

Composition: C (44.67%), H (5.15%), Br (37.15%), N (13.02%)

Molar Mass: 215.094

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.010561
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	XWASBZNKFJVMAU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.82
Topological Polar Surface Area	38.05
Polarizability	19.42
Ring Count	1
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	14088-81-4		$2,306.00-$3,510.00$2,306.00$3,510.00