Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C9H9F2N.C8H8O3 |
Molecular Weight | 321.3186 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@@H](C(O)=O)C1=CC=CC=C1.N[C@@H]2C[C@H]2C3=CC(F)=C(F)C=C3
InChI
InChIKey=GUESUQPLVFMJIT-KLTOLQSASA-N
InChI=1S/C9H9F2N.C8H8O3/c10-7-2-1-5(3-8(7)11)6-4-9(6)12;9-7(8(10)11)6-4-2-1-3-5-6/h1-3,6,9H,4,12H2;1-5,7,9H,(H,10,11)/t6-,9+;7-/m01/s1
Molecular Formula | C8H8O3 |
Molecular Weight | 152.1473 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C9H9F2N |
Molecular Weight | 169.1713 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:39:45 GMT 2023
by
admin
on
Sat Dec 16 15:39:45 GMT 2023
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Record UNII |
TH0OSF4LF9
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Record Status |
Validated (UNII)
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Record Version |
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-
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DTXSID60433193
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376608-71-8
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9944965
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1667188
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admin on Sat Dec 16 15:39:45 GMT 2023 , Edited by admin on Sat Dec 16 15:39:45 GMT 2023
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