Cas no 39180-38-6 ([1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester)
![[1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester structure](https://ossimg.kuujia.com/scimg/39500/39180-38-6x500.png)
39180-38-6 structure
Product Name:[1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester
CAS No:39180-38-6
MF:C16H15NO3
MW:269.295204401016
CID:306113
PubChem ID:38228
Update Time:2025-04-19
[1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester
- methyl 3-acetamido-4-phenylbenzoate
- 2-Acetamido-4-carbometossibifenile [Italian]
- DTXSID80192412
- 39180-38-6
- BRN 2862601
- 2-Acetamido-4-carbometossibifenile
- 2-Acetamido-4-biphenylcarboxylic acid methyl ester
- 4-BIPHENYLCARBOXYLIC ACID, 2-ACETAMIDO-, METHYL ESTER
- 4-biphenylcarboxylic acid,2-acetamido-,methyl ester
-
- Inchi： 1S/C16H15NO3/c1-11(18)17-15-10-13(16(19)20-2)8-9-14(15)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,17,18)
- InChI Key： REJSESURCIXBRC-UHFFFAOYSA-N
- SMILES： O(C)C(C1C=CC(C2C=CC=CC=2)=C(C=1)NC(C)=O)=O
Computed Properties
- Exact Mass: 269.10525
- Monoisotopic Mass: 269.105193
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 350
- 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
- Topological Polar Surface Area: 55.4
- XLogP3: 2.6
Experimental Properties
- Density: 1.193
- Boiling Point: 443.9°C at 760 mmHg
- Flash Point: 222.3°C
- Refractive Index: 1.596
- PSA: 55.4
[1,1'-Biphenyl]-4-carboxylicacid, 2-(acetylamino)-, methyl ester Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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