4-(3-carboxypropanamido)benzoic acid

4-(3-carboxypropanamido)benzoic acid

Formula: C11H11NO5

SMILES: OC(=O)CCC(=O)NC1=CC=C(C=C1)C(O)=O

IUPAC: 4-(3-carboxypropanamido)benzoic acid

InChI: InChI=1S/C11H11NO5/c13-9(5-6-10(14)15)12-8-3-1-7(2-4-8)11(16)17/h1-4H,5-6H2,(H,12,13)(H,14,15)(H,16,17)

Composition: C (55.70%), H (4.67%), N (5.90%), O (33.72%)

Molar Mass: 237.211

Atom Count: 28

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	237.063722458
Formal Charge	0
FSP3	0.18
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	IOKXKKSBNJCKOY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.07
Topological Polar Surface Area	103.7
Polarizability	21.87
Ring Count	1
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C11H11NO5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00