5-azido-4-(benzyloxy)-2-[(benzyloxy)methyl]-6-(4-methoxyphenoxy)oxan-3-ol

5-azido-4-(benzyloxy)-2-[(benzyloxy)methyl]-6-(4-methoxyphenoxy)oxan-3-ol

CAS: 1272755-25-5

Formula: C27H29N3O6

SMILES: COC1=CC=C(OC2OC(COCC3=CC=CC=C3)C(O)C(OCC3=CC=CC=C3)C2N=[N+]=[N-])C=C1

IUPAC: 5-azido-4-(benzyloxy)-2-[(benzyloxy)methyl]-6-(4-methoxyphenoxy)oxan-3-ol

InChI: InChI=1/C27H29N3O6/c1-32-21-12-14-22(15-13-21)35-27-24(29-30-28)26(34-17-20-10-6-3-7-11-20)25(31)23(36-27)18-33-16-19-8-4-2-5-9-19/h2-15,23-27,31H,16-18H2,1H3

Composition: C (65.98%), H (5.95%), N (8.55%), O (19.53%)

Molar Mass: 491.544

Atom Count: 65

Heavy Atom Count: 36

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	5
Exact Mass	491.205635666
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
InChIKey	ZTAXYCGZXSYIMV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	131.67
Topological Polar Surface Area	95.81
Polarizability	51.68
Ring Count	4
Rotatable Bond Count	11

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