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Home > Encyclopedia > 1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate

1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate

1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate structure

1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate 

structure
  • CAS No:

    1009075-43-7

  • Formula:

    C9H17FN2O2

  • Chemical Name:

    1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate

  • Synonyms:

    1-Pyrrolidinecarboxylic acid,3-amino-4-fluoro-,1,1-dimethylethyl ester,(3S,4S)-;1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

1,1-Dimethylethyl (3S,4S)-3-amino-4-fluoro-1-pyrrolidinecarboxylate Basic Attributes

204.24

204.24

DTXSID30670492

Characteristics

1.13

266.1±40.0 °C(Predicted)

8.29±0.40

Safety Information

6.1

2811

|Warning|H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]|P264, P280, P302+P352, P305+P351+P338, P312, P322, P337+P313, P363, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:204.24
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:204.12740595
Monoisotopic Mass:204.12740595
Topological Polar Surface Area:55.6
Heavy Atom Count:14
Complexity:227
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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