2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hept-6-ynoic acid

2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hept-6-ynoic acid

Formula: C22H21NO4

SMILES: OC(=O)C(CCCC#C)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

IUPAC: 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hept-6-ynoic acid

InChI: InChI=1/C22H21NO4/c1-2-3-4-13-20(21(24)25)23-22(26)27-14-19-17-11-7-5-9-15(17)16-10-6-8-12-18(16)19/h1,5-12,19-20H,3-4,13-14H2,(H,23,26)(H,24,25)

Composition: C (72.71%), H (5.82%), N (3.85%), O (17.61%)

Molar Mass: 363.413

Atom Count: 48

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	363.14705816
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	YWCKIQCRKHNUOY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.37
Topological Polar Surface Area	75.63
Polarizability	40.27
Ring Count	3
Rotatable Bond Count	8

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C22H21NO4		Quote Only