Cas no 16625-79-9 (Acetamide,N-(phenyl-4-d)- (9CI))
16625-79-9 structure
Product Name:Acetamide,N-(phenyl-4-d)- (9CI)
CAS No:16625-79-9
MF:C8H9NO
MW:136.169323682785
CID:137967
PubChem ID:12199322
Update Time:2025-04-19
Acetamide,N-(phenyl-4-d)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Acetamide,N-(phenyl-4-d)- (9CI)
- ACETANILIDE-4'-D1
- 4-Deutero-acetanilid
- AC1MDS0Z
- Acetanilid - markiert
- AG-A-40794
- CTK0I9637
- Essigsaeure-< 4-D> anilid
- N-(4-cyclohexyl-phenyl)-2-chloroacetamide
- N-(4-deuterio-phenyl)-acetamide
- N-(Chloroacetyl)-4-cyclohexylaniline
- SBB002362
- STL364537
- SureCN3824110
- ACETANILIDE-4-D1
- AKOS015910451
- N-(4-Deuteriophenyl)acetamide
- ACETANILIDE-4/'-D1
- 16625-79-9
-
- Inchi： 1S/C8H9NO/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)/i2D
- InChI Key： FZERHIULMFGESH-VMNATFBRSA-N
- SMILES： O=C(C)NC1C=CC([2H])=CC=1
Computed Properties
- Exact Mass: 137.08101
- Monoisotopic Mass: 136.075
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 116
- 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: 1.2
- Topological Polar Surface Area: 29.1A^2
Experimental Properties
- PSA: 29.1
Acetamide,N-(phenyl-4-d)- (9CI) Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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