Cas no 920317-67-5 (Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)-)
920317-67-5 structure
Product Name:Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)-
CAS No:920317-67-5
MF:C16H15NO
MW:237.296404123306
CID:757516
PubChem ID:16094589
Update Time:2025-04-19
Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)-
- 2-(2-benzyl-5-methoxyphenyl)acetonitrile
- DTXSID60582413
- 920317-67-5
- (2-Benzyl-5-methoxyphenyl)acetonitrile
-
- Inchi： 1S/C16H15NO/c1-18-16-8-7-14(15(12-16)9-10-17)11-13-5-3-2-4-6-13/h2-8,12H,9,11H2,1H3
- InChI Key： CSPKJMKLAYYKCK-UHFFFAOYSA-N
- SMILES： O(C)C1C=CC(=C(CC#N)C=1)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 237.115364102g/mol
- Monoisotopic Mass: 237.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 287
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 33?2
Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)- Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
920317-67-5 (Benzeneacetonitrile, 5-methoxy-2-(phenylmethyl)-) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
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