3-(3-bromophenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

3-(3-bromophenyl)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

CAS: 276262-71-6

Formula: C24H20BrNO4

SMILES: OC(=O)CC(NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C1=CC=CC(Br)=C1

IUPAC: 3-(3-bromophenyl)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid

InChI: InChI=1/C24H20BrNO4/c25-16-7-5-6-15(12-16)22(13-23(27)28)26-24(29)30-14-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-12,21-22H,13-14H2,(H,26,29)(H,27,28)

Composition: C (61.82%), H (4.32%), Br (17.13%), N (3.00%), O (13.72%)

Molar Mass: 466.331

Atom Count: 50

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	465.057571
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	KGNRGFVZQISFCT-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	116.69
Topological Polar Surface Area	75.63
Polarizability	46.27
Ring Count	4
Rotatable Bond Count	7

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	276262-71-6		$55.89-$215.28$55.89$87.98$215.28