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168683-02-1

168683-02-1 Structure

168683-02-1 Structure
IdentificationBack Directory
[Name]

4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-CYCLOPENTENE-1-CARBOXYLIC ACID METHYL ESTER
[CAS]

168683-02-1
[Synonyms]

PeraMivir InterMediate
4-((tert-butoxycarbonyl)aMino)cyclopent-2-enecarboxylate
Methyl 4-((tert-butoxycarbonyl)aMino)cyclopent-2-enecarboxylate
(1S,4R)-methyl 4-(tert-butoxycarbonyl)cyclopent-2-enecarboxylate
Cis-(1S,4R)-4-Boc-aMino-2-Cyclopentene-1-carboxylic acid Methyl ester
(1S,4R)-Methyl 4-((tert-butoxycarbonyl)aMino)cyclopent-2-enecarboxylate
methyl(1S,4R)-4-((tert-butoxycarbonyl)amino)cyclopent-2-ene-1-carboxylate
4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-CYCLOPENTENE-1-CARBOXYLIC ACID METHYL ESTER
methyl (1S,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopent-2-ene-1-carboxylate
2-Cyclopentene-1-carboxylic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (1S,4R)-
[EINECS(EC#)]

1308068-626-2
[Molecular Formula]

C12H19NO4
[MDL Number]

MFCD07367802
[MOL File]

168683-02-1.mol
[Molecular Weight]

241.28
Chemical PropertiesBack Directory
[Boiling point ]

331.2±42.0 °C(Predicted)
[density ]

1.10±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

Chloroform (Sparingly), Methanol (Slightly)
[form ]

Solid
[pka]

11.75±0.40(Predicted)
[color ]

Off-White to Pale Beige
[InChI]

InChI=1S/C12H19NO4/c1-12(2,3)17-11(15)13-9-6-5-8(7-9)10(14)16-4/h5-6,8-9H,7H2,1-4H3,(H,13,15)/t8-,9+/m1/s1
[InChIKey]

HKLDTKMTZPXEAZ-BDAKNGLRSA-N
[SMILES]

[C@H]1(C(OC)=O)C[C@@H](NC(OC(C)(C)C)=O)C=C1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
Hazard InformationBack Directory
[Uses]

(1S,?4R)?-4-?[[(1,?1-?Dimethylethoxy)?carbonyl]?amino]?-2-?cyclopentene-?1-?carboxylic Acid Methyl Ester is an intermediate in the synthesis of Peramivir (P285500).
Spectrum DetailBack Directory
[Spectrum Detail]

4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-2-CYCLOPENTENE-1-CARBOXYLIC ACID METHYL ESTER(168683-02-1)1HNMR
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