1-(thiophene-2-carbonyl)piperazine; trifluoroacetic acid

1-(thiophene-2-carbonyl)piperazine; trifluoroacetic acid

CAS: 477204-94-7

Formula: C11H13F3N2O3S

SMILES: OC(=O)C(F)(F)F.O=C(N1CCNCC1)C1=CC=CS1

IUPAC: 1-(thiophene-2-carbonyl)piperazine; trifluoroacetic acid

InChI: InChI=1S/C9H12N2OS.C2HF3O2/c12-9(8-2-1-7-13-8)11-5-3-10-4-6-11;3-2(4,5)1(6)7/h1-2,7,10H,3-6H2;(H,6,7)

Composition: C (42.58%), H (4.22%), F (18.37%), N (9.03%), O (15.47%), S (10.33%)

Molar Mass: 310.29

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	310.05989795
Formal Charge	0
FSP3	0.45
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	BLRUMSYYHSFSKQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.58
Topological Polar Surface Area	32.34
Polarizability	20.02
Ring Count	2
Rotatable Bond Count	2

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95%	<4 Days	477204-94-7		$58.65-$232.30$58.65$232.30