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| | 5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile Basic information |
| Product Name: | 5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile | | Synonyms: | 2-[3-(1-Cyano-1-methylethyl)-5-(hydroxymethyl)phenyl]-2-methylpropanenitrile;5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile;2-[3-(1-Cyano-1-Methylethyl)-5-(hydroxyMethyl)phenyl]-2-;1,3-Benzenediacetonitrile, 5-(hydroxyMethyl)-α1,α1,α3,α3-tetraMethyl-;Anastrozole EP Impurity E;2,2'-[5-(Hydroxymethyl)-1,3-phenylene]bis(2-methylpropanenitrile);2,2'-[5-(hydroxymethyl)benzene-1,3- diyl]bis(2-methylpropanenitrile);Anastrozole Impurity 10（EP Impurity E） | | CAS: | 120511-88-8 | | MF: | C15H18N2O | | MW: | 242.32 | | EINECS: | | | Product Categories: | | | Mol File: | 120511-88-8.mol |  |
| | 5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile Chemical Properties |
| Melting point | 150-160℃ | | Boiling point | 382.3±37.0 °C(Predicted) | | density | 1.084 | | solubility | Chloroform (Slightly), Methanol (Slightly) | | form | Solid | | pka | 14.34±0.10(Predicted) | | color | White to Off-White | | InChI | InChI=1S/C15H18N2O/c1-14(2,9-16)12-5-11(8-18)6-13(7-12)15(3,4)10-17/h5-7,18H,8H2,1-4H3 | | InChIKey | PLEAQICJSGOGID-UHFFFAOYSA-N | | SMILES | C1(C(C)(C)C#N)=CC(CO)=CC(C(C)(C)C#N)=C1 |
| | 5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile Usage And Synthesis |
| Uses | 2-[3-(Cyanodimethylmethyl)-5-hydroxymethylphenyl]-2-methylpropionitrile (Anastrozole EP Impurity E ) is an impurity of Anastrozole (A637425), an aromatase inhibitor which functions as an antineoplastic (1,2). Anastrozole is used in post-menopausal women with advanced breast cancer. | | Definition | ChEBI: 2-[3-(2-cyanopropan-2-yl)-5-(hydroxymethyl)phenyl]-2-methylpropanenitrile is an alkylbenzene. |
| | 5-(Hydroxymethyl)-alpha,alpha,alpha',alpha'-tetramethyl-1,3-benzenediacetonitrile Preparation Products And Raw materials |
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