2-amino-3-phenoxypropanoic acid

2-amino-3-phenoxypropanoic acid

CAS: 59123-22-7

Formula: C9H11NO3

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

IUPAC: 2-amino-3-phenoxypropanoic acid

InChI: InChI=1/C9H11NO3/c10-8(9(11)12)6-13-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)

Composition: C (59.66%), H (6.12%), N (7.73%), O (26.49%)

Molar Mass: 181.191

Atom Count: 24

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	181.073893218
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	JQBDLDSXPJLCFK-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.3
Topological Polar Surface Area	72.55
Polarizability	18.58
Ring Count	1
Rotatable Bond Count	4

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97%	<2 Days	59123-22-7		$157.55-$3,185.50$157.55$201.25$286.35$458.85$802.70$3,185.50