Chem
J-GLOBAL ID:200907096045788234
Nikkaji number:J2.667.318F
(3R)-3-(Trifluoromethyl)-3-hydroxy-5,7-di-tert-butylbenzofuran-2(3H)-one
(3R)-3-(トリフルオロメチル)-3-ヒドロキシ-5,7-ジ-tert-ブチルベンゾフラン-2(3H)-オン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C17 H21 F3 O3
Molecular formula furigana:
C17-H21-F3-O3
Molecular weight:
330.347
InChI:
InChI=1S/C17H21F3O3/c1-14(2,3)9-7-10(15(4,5)6)12-11(8-9)16(22,13(21)23-12)17(18,19)20/h7-8,22H,1-6H3/t16-/m1/s1
InChI key:
RVNOANDLZIIFHB-MRXNPFEDSA-N
SMILES:
CC(C)(C)c1cc2c(OC(=O)[C@@]2(O)C(F)(F)F)c(c1)C(C)(C)C
Systematic name (3):
(3R)-3-(トリフルオロメチル)-3-ヒドロキシ-5,7-ジ-tert-ブチルベンゾフラン-2(3H)-オン
(3R)-5,7-ジ-tert-ブチル-3-ヒドロキシ-3-(トリフルオロメチル)-2,3-ジヒドロ-1-ベンゾフラン-2-オン
(3R)-5,7-di-tert-butyl-3-hydroxy-3-(trifluoromethyl)-2,3-dihydro-1-benzofuran-2-one
Other name (1):
(3R)-3-(Trifluoromethyl)-3-hydroxy-5,7-di-tert-butylbenzofuran-2(3H)-one
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