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3-[(4-formylphenyl)(methyl)amino]propanoic acid

3-[(4-formylphenyl)(methyl)amino]propanoic acid

Formula: C11H13NO3

SMILES: CN(CCC(O)=O)C1=CC=C(C=O)C=C1

IUPAC: 3-[(4-formylphenyl)(methyl)amino]propanoic acid

InChI: InChI=1S/C11H13NO3/c1-12(7-6-11(14)15)10-4-2-9(8-13)3-5-10/h2-5,8H,6-7H2,1H3,(H,14,15)

Composition: C (63.76%), H (6.32%), N (6.76%), O (23.16%)

Molar Mass: 207.229

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 207.089543283
Formal Charge 0
FSP3 0.27
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MHNBHSBXTJIZFG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.85
Topological Polar Surface Area 57.61
Polarizability 21.26
Ring Count 1
Rotatable Bond Count 5

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Purity (%)
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Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C11H13NO3 Quote Only