3-[(3,5-dimethylphenyl)amino]propanoic acid

3-[(3,5-dimethylphenyl)amino]propanoic acid

Formula: C11H15NO2

SMILES: CC1=CC(NCCC(O)=O)=CC(C)=C1

IUPAC: 3-[(3,5-dimethylphenyl)amino]propanoic acid

InChI: InChI=1S/C11H15NO2/c1-8-5-9(2)7-10(6-8)12-4-3-11(13)14/h5-7,12H,3-4H2,1-2H3,(H,13,14)

Composition: C (68.37%), H (7.82%), N (7.25%), O (16.56%)

Molar Mass: 193.246

Atom Count: 29

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	193.110278727
Formal Charge	0
FSP3	0.36
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	PGAGGEQLCSLYEO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.12
Topological Polar Surface Area	49.33
Polarizability	21.03
Ring Count	1
Rotatable Bond Count	4

Suppliers

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H15NO2		Quote Only