4-amino-3-(4-bromophenyl)butanoic acid

4-amino-3-(4-bromophenyl)butanoic acid

CAS: 1134-46-9

Formula: C10H12BrNO2

SMILES: NCC(CC(O)=O)C1=CC=C(Br)C=C1

IUPAC: 4-amino-3-(4-bromophenyl)butanoic acid

InChI: InChI=1/C10H12BrNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)

Composition: C (46.53%), H (4.69%), Br (30.96%), N (5.43%), O (12.40%)

Molar Mass: 258.115

Atom Count: 26

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	257.005142
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	SGNGZDZEUUMNCP-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.65
Topological Polar Surface Area	63.32
Polarizability	22.56
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	1134-46-9		$1,920.00-$3,872.00$1,920.00$2,420.00$3,872.00