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methyl 2-[2-({[(tert-butoxycarbonyl)amino]oxy}methyl)phenyl]-2-(methoxyimino)acetate

methyl 2-[2-({[(tert-butoxycarbonyl)amino]oxy}methyl)phenyl]-2-(methoxyimino)acetate

CAS: 2459977-70-7

Formula: C16H22N2O6

SMILES: CON=C(C(=O)OC)C1=CC=CC=C1CONC(=O)OC(C)(C)C

IUPAC: methyl 2-{2-[({[(tert-butoxy)carbonyl]amino}oxy)methyl]phenyl}-2-(methoxyimino)acetate

InChI: InChI=1S/C16H22N2O6/c1-16(2,3)24-15(20)18-23-10-11-8-6-7-9-12(11)13(17-22-5)14(19)21-4/h6-9H,10H2,1-5H3,(H,18,20)

Composition: C (56.80%), H (6.55%), N (8.28%), O (28.37%)

Molar Mass: 338.36

Atom Count: 46

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 338.147786436
Formal Charge 0
FSP3 0.44
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey SMHYWHTZUXYXNC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 86.03
Topological Polar Surface Area 95.45
Polarizability 33.58
Ring Count 1
Rotatable Bond Count 9

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95% <5 Days 2459977-70-7 $126.10-$339.21$126.10$339.21
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