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

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

CAS: 2305079-45-0

Formula: C7H14ClNO3

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

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

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

Composition: C (42.97%), H (7.21%), Cl (18.12%), N (7.16%), O (24.53%)

Molar Mass: 195.64

Atom Count: 26

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 195.066221
Formal Charge 0
FSP3 0.86
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FMWMGVFZENRYGU-GEMLJDPKSA-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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Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 2305079-45-0 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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