1-(3-Nitrophenyl)piperazine

Modify Date: 2025-08-25 10:37:54

1-(3-Nitrophenyl)piperazine structure	Common Name	1-(3-Nitrophenyl)piperazine
	CAS Number	54054-85-2	Molecular Weight	207.229
	Density	1.2±0.1 g/cm3	Boiling Point	377.5±27.0 °C at 760 mmHg
	Molecular Formula	C₁₀H₁₃N₃O₂	Melting Point	N/A
	MSDS	N/A	Flash Point	182.1±23.7 °C

Name	1-(3-Nitrophenyl)piperazine
Synonym	More Synonyms

Density	1.2±0.1 g/cm3
Boiling Point	377.5±27.0 °C at 760 mmHg
Molecular Formula	C₁₀H₁₃N₃O₂
Molecular Weight	207.229
Flash Point	182.1±23.7 °C
Exact Mass	207.100784
PSA	61.09000
LogP	1.52
Vapour Pressure	0.0±0.9 mmHg at 25°C
Index of Refraction	1.579
InChIKey	LHHZRIYUOZPKSG-UHFFFAOYSA-N
SMILES	O=[N+]([O-])c1cccc(N2CCNCC2)c1
Storage condition	2-8°C

Hazard Codes	C
RIDADR	3259.0
HS Code	2933599090

Piperazine

CAS#:110-85-0

3-Fluoronitrobenzene

CAS#:402-67-5

~74%

1-(3-Nitropheny...

CAS#:54054-85-2

Literature: INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) Patent: EP1683790 A1, 2006 ; Location in patent: Page/Page column 7; 12 ; EP 1683790 A1

Bis(2-Chloroeth...

CAS#:821-48-7

3-Nitroaniline

CAS#:99-09-2

~45%

1-(3-Nitropheny...

CAS#:54054-85-2

Literature: Sun, Aiming; Moore, Terry W.; Gunther, Jillian R.; Kim, Mi-Sun; Rhoden, Eric; Du, Yuhong; Fu, Haian; Snyder, James P.; Katzenellenbogen, John A. ChemMedChem, 2011 , vol. 6, # 4 p. 654 - 666

N-Carbethoxy Pi...

CAS#:120-43-4

SodiuM bicarbonate

CAS#:144-55-8

3-Nitrobenzyl b...

CAS#:3958-57-4

~59%

1-Ethoxycarbony...

CAS#:314061-13-7

Detail

Literature: Teuber, Lene; Watjen, Frank Patent: US2003/55055 A1, 2003 ;

Piperazine

CAS#:110-85-0

1-Iodo-3-nitrob...

CAS#:645-00-1

1-(3-Nitropheny...

CAS#:54054-85-2

Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 17, # 22 p. 6245 - 6249

Precursor 8
CAS#:110-85-0 Piperazine CAS#:402-67-5 3-Fluoronitrobenzene CAS#:821-48-7 Bis(2-Chloroeth... CAS#:99-09-2 3-Nitroaniline
CAS#:120-43-4 N-Carbethoxy Pi... CAS#:144-55-8 SodiuM bicarbonate CAS#:3958-57-4 3-Nitrobenzyl b... CAS#:645-00-1 1-Iodo-3-nitrob...
DownStream 3
CAS#:148546-97-8 1-Methyl-4-(3-n... CAS#:148546-99-0 3-(4-Methylpipe... CAS#:740873-06-7 Naluzotan

HS Code	2933599090
Summary	2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Name: Inhibition of [3H]5-HT radioligand binding against 5-hydroxytryptamine 1 receptor
Source: ChEMBL
Target: 5-hydroxytryptamine receptor 1F
External Id: CHEMBL615486

Name: Binding affinity at rat 5-hydroxytryptamine 1B receptor by [3H]5-HT displacement.
Source: ChEMBL
Target: 5-hydroxytryptamine receptor 1B
External Id: CHEMBL872909

Name: Binding affinity at rat 5-hydroxytryptamine 1A receptor by [3H]WB-4101 displacement.
Source: ChEMBL
Target: 5-hydroxytryptamine receptor 1A
External Id: CHEMBL616953

Name: Effective dose in blocking conditioned avoidance responding (CAR) in the rat when adm...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL781290

Name: Binding affinity against rat Dopamine receptor D2.
Source: ChEMBL
Target: D(2) dopamine receptor
External Id: CHEMBL674682

Name: The percent loss of escape responding was determined for the estimated effective dose...
Source: ChEMBL
Target: Rattus norvegicus
External Id: CHEMBL799459

Name: Binding affinity at rat 5-hydroxytryptamine 2 receptor by [3H]ketanserin displacement...
Source: ChEMBL
Target: 5-hydroxytryptamine receptor 2B
External Id: CHEMBL617536

Name: Binding affinity at rat Dopamine receptor D1 by [3H]SCH-23390 displacement.
Source: ChEMBL
Target: D(1A) dopamine receptor
External Id: CHEMBL672014

Name: Binding affinity against rat Alpha-1 adrenergic receptor.
Source: ChEMBL
Target: Alpha-1A adrenergic receptor
External Id: CHEMBL651986

Name: Chan-Lam from Article : "Open science discovery of potent noncovalent SARS-CoV-2 main...
Source: BindingDB
Target: N/A
External Id: BindingDB_11549_1

Total 10, Current Page 1 of 1

4-(3'-nitrophenyl)piperazine

(3-nitrophenyl)piperazine

1-(3-Nitrophenyl)piperazine

1-(3-nitrophenyl)-piperazine

1-(m-nitrophenyl)piperazine