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Home > Encyclopedia > 2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI)

2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI)

2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI) structure

2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI) 

structure
  • CAS No:

    111193-38-5

  • Formula:

    C6H6F3NO3

  • Chemical Name:

    2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI)

  • Synonyms:

    SCHEMBL18016774;DTXSID40664221;2-AZIRIDINECARBOXYLIC ACID, 1-(TRIFLUOROACETYL)-, METHYL ESTER, (S)-;Methyl (2S)-1-(trifluoroacetyl)aziridine-2-carboxylate

2-Aziridinecarboxylic acid, 1-(trifluoroacetyl)-, methyl ester, (S)- (9CI) Basic Attributes

197.1119496

197.03

DTXSID40664221

Characteristics

46.4

0.6

1.521±0.06 g/cm3(Predicted)

261.8±40.0 °C(Predicted)

Computed Properties

Molecular Weight:197.11
XLogP3:0.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:197.02997754
Monoisotopic Mass:197.02997754
Topological Polar Surface Area:46.4
Heavy Atom Count:13
Complexity:250
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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