Posaconazole structure, CAS 171228-49-2

Posaconazole

CAS Number171228-49-2

SynonymsPcz; EINECS 200-659-6; Noxafil; HYDROXYPROPYL]-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE; T6N DNTJ AR D- DT5NNVJ BY2&YQ1&& DR DO1- DT5OTJ BR BF DF& B1- AT5NN DNJ &&Stereoisomer; Pos; Posconazole; Posaconazole

Molecular FormulaC37H42F2N8O4

Molecular Weight700.78

Purity

Density1.4±0.1 g/cm3

Boiling Point850.7±75.0 °C at 760 mmHg

Melting Point170-1720C

Flash Point

Appearancewhite solid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9092745 Purity:
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Quality Control of [ 171228-49-2 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number171228-49-2
Catalog No.2A-9092745
Chinese Name泊沙康唑
SynonymsPcz; EINECS 200-659-6; Noxafil; HYDROXYPROPYL]-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE; T6N DNTJ AR D- DT5NNVJ BY2&YQ1&& DR DO1- DT5OTJ BR BF DF& B1- AT5NN DNJ &&Stereoisomer; Pos; Posconazole; Posaconazole
Molecular FormulaC37H42F2N8O4
Molecular Weight700.78
Density1.4±0.1 g/cm3
Boiling Point850.7±75.0 °C at 760 mmHg
Melting Point170-1720C
Appearancewhite solid
Storage Condition-20°C Freezer
ApplicationPosaconazole is a broad-spectrum, second-generation triazole with antifungal effects.
PubChem ID329753992
SMILESCCC(C(C)O)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(F)cc6F)C5)cc4)CC3)cc2)c1=O
InChIInChI=1S/C37H42F2N8O4/c1-3-35(26(2)48)47-36(49)46(25-42-47)31-7-5-29(6-8-31)43-14-16-44(17-15-43)30-9-11-32(12-10-30)50-20-27-19-37(51-21-27,22-45-24-40-23-41-45)33-13-4-28(38)18-34(33)39/h4-13,18,23-27,35,48H,3,14-17,19-22H2,1-2H3/t26-,27+,35-,37-/m0/s1
InChI KeyRAGOYPUPXAKGKH-XAKZXMRKSA-N
Transport InfoProduct Name: Posaconazole
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