Chem
J-GLOBAL ID：200907086849944349
Nikkaji number：J1.429.990D
(2S)-1,1-Bis(3,5-di-tert-butylphenyl)-2-amino-1-propanol
(2S)-1,1-ビス(3,5-ジ-tert-ブチルフェニル)-2-アミノ-1-プロパノール
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
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
Molecular formula： C31H49NO
Molecular formula furigana： C31-H49-N-O
Molecular weight： 451.739
InChI：
InChI=1S/C31H49NO/c1-20(32)31(33,25-16-21(27(2,3)4)14-22(17-25)28(5,6)7)26-18-23(29(8,9)10)15-24(19-26)30(11,12)13/h14-20,33H,32H2,1-13H3/t20-/m0/s1
InChI key：
YZXZVGVIKYGLAV-FQEVSTJZSA-N
SMILES：
C[C@H](N)C(O)(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C
Systematic name (3)：
- (2S)-1,1-ビス(3,5-ジ-tert-ブチルフェニル)-2-アミノ-1-プロパノール
- (2S)-2-アミノ-1,1-ビス(3,5-ジ-tert-ブチルフェニル)プロパン-1-オール
- (2S)-2-amino-1,1-bis(3,5-di-tert-butylphenyl)propan-1-ol
- (2S)-1,1-Bis(3,5-di-tert-butylphenyl)-2-amino-1-propanol
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