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2-(2-Fluorophenyl)piperazine

HCID 13787447
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
137684-18-5
Standard SMILES
Fc1ccccc1C1CNCCN1
InChIKey
JMLSZQAVDKFFCE-UHFFFAOYSA-N
Molecular formula
C10H13FN2
Average molar mass
180.22 g/mol
Monoisotopic mass
180.10627659

Names & identifiers

Preferred name
2-(2-Fluorophenyl)piperazine
IUPAC
2-(2-fluorophenyl)piperazine
English name
Piperazine, 2-(2-fluorophenyl)- (9CI)
Molecular formula
C10H13FN2
Molecular weight
180.22

Names & synonyms

2-(2-Fluorophenyl)piperazine137684-18-5DTXSID30549452RefChem:250682DTXCID40500236PIPERAZINE, 2-(2-FLUOROPHENYL)-MFCD07373075Piperazine, 2-(2-fluorophenyl)- (9CI)(2R)-2-(2-FLUOROPHENYL)PIPERAZINE2-(2-Fluorophenyl)-piperazine 2HCl2-(fluorophenyl)piperazine2-(2-fluorophenyl)-piperazine
Show more names
SCHEMBL3549378SCHEMBL4533549SCHEMBL30397619JMLSZQAVDKFFCE-UHFFFAOYSA-N1213100-09-4(RS)-2-(2-fluorophenyl)piperazineSBB089692AKOS006284087

Database identifiers

CAS
137684-18-5
PubChem CID
13787447
DTXSID
DTXSID30549452

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
24.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
163

Physicochemical properties

Boiling point
270 · 270.0±35.0 °C(Predicted)
Density
1.079 · 1.079±0.06 g/cm3(Predicted)
storage temp.
Store at Room Tem.
pka
8.53 · 8.53±0.40(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Chemistry & industry

Suppliers5 total

上海洪创医药科技有限公司18151128828 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
四川铂友生物科技有限公司(原四川佰朋)028-65791793 18140026355 · [email protected]
佰美济华(河南)医药科技有限公司0371-88900765 18037465274 · [email protected]

Related reactions

2 records
New reaction record
HRID 291726 reaction equation
HRID 291726As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 344902 reaction equation
HRID 344902As reactantuspto-grants-1991_10

Compound notes

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