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sodium 2-{[(2-methoxyphenyl)methyl]amino}acetate

sodium 2-{[(2-methoxyphenyl)methyl]amino}acetate

CAS: 1609399-84-9

Formula: C10H12NNaO3

SMILES: [Na+].COC1=C(CNCC([O-])=O)C=CC=C1

IUPAC: sodium 2-{[(2-methoxyphenyl)methyl]amino}acetate

InChI: InChI=1S/C10H13NO3.Na/c1-14-9-5-3-2-4-8(9)6-11-7-10(12)13;/h2-5,11H,6-7H2,1H3,(H,12,13);/q;+1/p-1

Composition: C (55.30%), H (5.57%), N (6.45%), Na (10.58%), O (22.10%)

Molar Mass: 217.2

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 217.07148753
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VWTYHIKHMXDNSW-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 62.69
Topological Polar Surface Area 61.39
Polarizability 20.3
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1609399-84-9 $58.65-$500.25$58.65$186.30$500.25
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