ethyl (1R,2R,3S,4S)-4-azido-2-[(tert-butoxycarbonyl)amino]-3-hydroxycyclopentane-1-carboxylate

ethyl (1R,2R,3S,4S)-4-azido-2-[(tert-butoxycarbonyl)amino]-3-hydroxycyclopentane-1-carboxylate

CAS: 959745-89-2

Formula: C13H22N4O5

SMILES: CCOC(=O)[C@@H]1C[C@H](N=[N+]=[N-])[C@@H](O)[C@@H]1NC(=O)OC(C)(C)C

IUPAC: ethyl (1R,2R,3S,4S)-4-azido-2-{[(tert-butoxy)carbonyl]amino}-3-hydroxycyclopentane-1-carboxylate

InChI: InChI=1S/C13H22N4O5/c1-5-21-11(19)7-6-8(16-17-14)10(18)9(7)15-12(20)22-13(2,3)4/h7-10,18H,5-6H2,1-4H3,(H,15,20)/t7-,8+,9+,10-/m1/s1

Composition: C (49.67%), H (7.05%), N (17.82%), O (25.45%)

Molar Mass: 314.342

Atom Count: 44

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	4
Exact Mass	314.159019824
Formal Charge	0
FSP3	0.85
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	OQBGDQJMLWENBU-UTINFBMNSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.82
Topological Polar Surface Area	114.29
Polarizability	29.68
Ring Count	1
Rotatable Bond Count	7

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	959745-89-2		$447.12-$1,010.16$447.12$1,010.16