Cas no 13158-31-1 (1,4-Benzenedicarboxamide,N1,N1,N4,N4-tetramethyl-)
13158-31-1 structure
Product Name:1,4-Benzenedicarboxamide,N1,N1,N4,N4-tetramethyl-
CAS No:13158-31-1
MF:C12H16N2O2
MW:220.267642974854
CID:215999
PubChem ID:244990
Update Time:2025-04-19
1,4-Benzenedicarboxamide,N1,N1,N4,N4-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenedicarboxamide,N1,N1,N4,N4-tetramethyl-
- 13158-31-1
- SCHEMBL1004649
- DTXSID00876868
- 1,4-Benzenedicarboxamide, N,N,N',N'-tetramethyl-
- NSC56421
- NSC-56421
-
- Inchi： 1S/C12H16N2O2/c1-13(2)11(15)9-5-7-10(8-6-9)12(16)14(3)4/h5-8H,1-4H3
- InChI Key： MKIKJJUYURBXJT-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(C(N(C)C)=O)=CC=1)N(C)C
Computed Properties
- Exact Mass: 220.12128
- Monoisotopic Mass: 220.121
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 238
- 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: 0.4
- Topological Polar Surface Area: 40.6?2
Experimental Properties
- Density: 1.101
- Boiling Point: 409.8°C at 760 mmHg
- Flash Point: 190.2°C
- Refractive Index: 1.542
- PSA: 40.62
1,4-Benzenedicarboxamide,N1,N1,N4,N4-tetramethyl- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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