4-(piperidine-1-carbonyl)benzoic acid

4-(piperidine-1-carbonyl)benzoic acid

CAS: 210961-92-5

Formula: C13H15NO3

SMILES: OC(=O)C1=CC=C(C=C1)C(=O)N1CCCCC1

IUPAC: 4-(piperidine-1-carbonyl)benzoic acid

InChI: InChI=1S/C13H15NO3/c15-12(14-8-2-1-3-9-14)10-4-6-11(7-5-10)13(16)17/h4-7H,1-3,8-9H2,(H,16,17)

Composition: C (66.94%), H (6.48%), N (6.00%), O (20.58%)

Molar Mass: 233.267

Atom Count: 32

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.105193347
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	CCQPDDNFTHQPCX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.33
Topological Polar Surface Area	57.61
Polarizability	23.98
Ring Count	2
Rotatable Bond Count	2

Suppliers

Acrotein ChemBio Inc.,

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97%	<7 Days	210961-92-5		$175.68-$751.68$175.68$263.04$751.68

Struchem co.,ltd

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