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111628-39-8

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111628-39-8 Structure

111628-39-8 Structure
IdentificationBack Directory
[Name]

2-PIPERAZIN-1-YL-BENZOOXAZOLE
[CAS]

111628-39-8
[Synonyms]

BUTTPARK 120\07-01
CHEMBRDG-BB 4102378
2-PIPERAZINO-1,3-BENZOXAZOLE
2-PIPERAZIN-1-YL-BENZOOXAZOLE
Benzoxazole, 2-(1-piperazinyl)-
2-piperazin-1-yl-1,3-benzoxazole
2-(piperazin-1-yl)benzo[d]oxazole
2-piperazin-1-yl-1,3-benzoxazole(SALTDATA: FREE)
[Molecular Formula]

C11H13N3O
[MDL Number]

MFCD04035522
[MOL File]

111628-39-8.mol
[Molecular Weight]

203.24
Chemical PropertiesBack Directory
[Melting point ]

68-70 °C
[Boiling point ]

345.1±52.0 °C(Predicted)
[density ]

1.210±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[form ]

solid
[pka]

8.55±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C11H13N3O/c1-2-4-10-9(3-1)13-11(15-10)14-7-5-12-6-8-14/h1-4,12H,5-8H2
[InChIKey]

HLKHIJZYKGDCJM-UHFFFAOYSA-N
[SMILES]

C12=C(N=C(N3CCNCC3)O2)C=CC=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

22
[WGK Germany ]

WGK 3
[HazardClass ]

IRRITANT
[HS Code ]

2934999090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Synthesis Reference(s)]

Journal of Medicinal Chemistry, 41, p. 3015, 1998 DOI: 10.1021/jm9801004
Spectrum DetailBack Directory
[Spectrum Detail]

2-PIPERAZIN-1-YL-BENZOOXAZOLE(111628-39-8)1HNMR
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