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1620056-83-8

1620056-83-8 Structure

1620056-83-8 Structure
IdentificationBack Directory
[Name]

1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetic acid, 5,5-difluoro-3b,4,4a,5-tetrahydro-3-(trifluoromethyl)-, (3bS,4aR)-
[CAS]

1620056-83-8
[Synonyms]

2-[(2S,4R)-5,5-difluoro-9-(trifluoromethyl)-7,8-diazatricyclo[4.3.0.02,?]nona-1(6),8-dien-7-yl]acetic acid
1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetic acid, 5,5-difluoro-3b,4,4a,5-tetrahydro-3-(trifluoromethyl)-, (3bS,4aR)-
2-((3bS,4aR)-5,5-difluoro-3-(trifluoromethyl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl)acetic acid
2 - ((3Bs, 4ar) - 5,5-difluoro-3 - (trifluoromethyl) - 3b, 4,4a, 5-tetrahydro-1h-cyclopropane [3,4] cyclopentyl [1,2-c] pyrazole-1-yl) acetic acid
[Molecular Formula]

C10H7F5N2O2
[MOL File]

1620056-83-8.mol
[Molecular Weight]

282.17
Chemical PropertiesBack Directory
[Boiling point ]

325.8±42.0 °C(Predicted)
[density ]

1.96±0.1 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[pka]

3.49±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C10H7F5N2O2/c11-9(12)4-1-3(4)6-7(10(13,14)15)16-17(8(6)9)2-5(18)19/h3-4H,1-2H2,(H,18,19)/t3-,4+/m0/s1
[InChIKey]

KKEFPICWHXMILG-IUYQGCFVSA-N
[SMILES]

N1=C(C(F)(F)F)C2[C@@]3([H])C[C@@]3([H])C(F)(F)C=2N1CC(O)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetic acid, 5,5-difluoro-3b,4,4a,5-tetrahydro-3-(trifluoromethyl)-, (3bS,4aR)- is a pharmaceutical intermediate component, which can be used as a preparation of long-acting HIV capsid inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Cyclopropa[3,4]cyclopenta[1,2-c]pyrazole-1-acetic acid, 5,5-difluoro-3b,4,4a,5-tetrahydro-3-(trifluoromethyl)-, (3bS,4aR)-(1620056-83-8)1HNMR
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