Cas no 23982-57-2 (n-benzylmethylamino-acetone)
n-benzylmethylamino-acetone structure
Product Name:n-benzylmethylamino-acetone
CAS No:23982-57-2
MF:C11H15NO
MW:177.242902994156
CID:912852
PubChem ID:520083
Update Time:2025-04-19
n-benzylmethylamino-acetone Chemical and Physical Properties
Names and Identifiers
-
- n-benzylmethylamino-acetone
- (benzyl-methyl-amino)-acetone
- G67446
- MFCD00015626
- 1-[benzyl(methyl)amino]propan-2-one
- 1-(N-benzyl-n-methylamino)propan-2-one
- BKBKJBOVLPZZIU-UHFFFAOYSA-N
- DB-201208
- 23982-57-2
- SCHEMBL3106474
- 1-(benzyl-methylamino)propan-2-one
- 1-(benzyl(methyl)amino)propan-2-one
- 1-[benzyl(methyl)amino]acetone
- AKOS008963854
- (Benzylmethylamino)acetone
-
- Inchi： 1S/C11H15NO/c1-10(13)8-12(2)9-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3
- InChI Key： BKBKJBOVLPZZIU-UHFFFAOYSA-N
- SMILES： O=C(C)CN(C)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 177.11545
- Monoisotopic Mass: 177.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 162
- 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: 1.5
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
n-benzylmethylamino-acetone Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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