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methyl (3R,4S)-4-aminooxane-3-carboxylate

methyl (3R,4S)-4-aminooxane-3-carboxylate

CAS: 1903832-65-4

Formula: C7H13NO3

SMILES: COC(=O)[C@H]1COCC[C@@H]1N

IUPAC: methyl (3R,4S)-4-aminooxane-3-carboxylate

InChI: InChI=1S/C7H13NO3/c1-10-7(9)5-4-11-3-2-6(5)8/h5-6H,2-4,8H2,1H3/t5-,6-/m0/s1

Composition: C (52.82%), H (8.23%), N (8.80%), O (30.15%)

Molar Mass: 159.185

Atom Count: 24

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 159.089543283
Formal Charge 0
FSP3 0.86
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey PLVOQXPMPPTFRW-WDSKDSINSA-N
Lipinski's Rule of Five 1
Molar Refractivity 39.14
Topological Polar Surface Area 61.55
Polarizability 15.93
Ring Count 1
Rotatable Bond Count 2

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98% <2 Days 1903832-65-4 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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