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2-{[(4-methoxyphenyl)methyl]amino}propanoic acid

2-{[(4-methoxyphenyl)methyl]amino}propanoic acid

Formula: C11H15NO3

SMILES: COC1=CC=C(CNC(C)C(O)=O)C=C1

IUPAC: 2-{[(4-methoxyphenyl)methyl]amino}propanoic acid

InChI: InChI=1/C11H15NO3/c1-8(11(13)14)12-7-9-3-5-10(15-2)6-4-9/h3-6,8,12H,7H2,1-2H3,(H,13,14)

Composition: C (63.14%), H (7.23%), N (6.69%), O (22.94%)

Molar Mass: 209.245

Atom Count: 30

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 209.105193347
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey DVWKAPURRINTQG-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 56.35
Topological Polar Surface Area 58.56
Polarizability 22.25
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H15NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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