959745-90-5
ETHYL (1S*,2R*,3S*,4S*)-4-AZIDO-2-(TERT-BUTOXYCARBONYLAMINO)-3-HYDROXYCYCLOPENTANE-CARBOXYLATE
NameETHYL (1S*,2R*,3S*,4S*)-4-AZIDO-2-(TERT-BUTOXYCARBONYLAMINO)-3-HYDROXYCYCLOPENTANE-CARBOXYLATE
1Identification
【Name】
ETHYL (1S*,2R*,3S*,4S*)-4-AZIDO-2-(TERT-BUTOXYCARBONYLAMINO)-3-HYDROXYCYCLOPENTANE-CARBOXYLATE
【CAS】
【MDL】
MFCD09881427
【EnglishSynonyms】
【pro_formula】
C13 H22 N4 O5
【pro_molWeight】
314.34
【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+/m0/s1
【InChIKey】
InChIKey=OQBGDQJMLWENBU-AXTSPUMRSA-N
【SMILES】
CCOC(=O)[C@H]1C[C@@H]([C@H]([C@@H]1NC(=O)OC(C)(C)C)O)N=[N+]=[N-]
【MOL File】
ETHYL (1S*,2R*,3S*,4….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:9
XLogP3:2.0
Bulk/Fine:FB
3MaterialMSDS
4CMLFile
ETHYL (1S*,2R*,3S*,4S*)-4-AZIDO-2-(TERT-BUTOXYCARBONYLAMINO)-3-HYDROXYCYCLOPENTANE-CARBOXYLATE.cml