Cas no 28177-14-2 (1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]-)
![1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]- structure](https://ossimg.kuujia.com/scimg/28500/28177-14-2x500.png)
28177-14-2 structure
Product Name:1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]-
CAS No:28177-14-2
MF:C6H9ClN6O
MW:216.628258466721
CID:273903
PubChem ID:98658
Update Time:2025-04-19
1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]-
- 1H-Imidazole-4-carboxamide, 5-[3-(2-chloroethyl)-1-triazenyl ]-
- 5-(3-(2-chloroethyl)triazen-1-yl)imidazole-4-carboxamide
- 5-[3-(2-chloro-ethyl)-triazenyl]-1(3)H-imidazole-4-carboxylic acid amide
- 5-< 3-(2-chloroethyl)triazen-1-yl> imidazole-4-carboxamide
- SCHEMBL16048981
- DTXSID30950928
- 5[3-(2-chloroethyl)triazen-1-yl]imidazole-4-carboxamide
- 5-[3-(2-Chloroethyl)triaz-2-en-1-yl]-1H-imidazole-4-carboxamide
- 28177-14-2
- 1H-Imidazole-4-carboxamide, 5-(3-(2-chloroethyl)-1-triazenyl)-
- NSC157949
- NSC-157949
- NSC 157949
- Imidazole-4-carboxamide, 5-(3-(2-chloroethyl)-1-triazenyl)-
-
- Inchi： 1S/C6H9ClN6O/c7-1-2-11-13-12-6-4(5(8)14)9-3-10-6/h3H,1-2H2,(H2,8,14)(H,9,10)(H,11,12)
- InChI Key： NTSGCNCEAGGYGC-UHFFFAOYSA-N
- SMILES： ClCC/N=N/NC1=C(C(N)=O)NC=N1
Computed Properties
- Exact Mass: 216.05287
- Monoisotopic Mass: 216.052637
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 309
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 104
- XLogP3: 1.1
Experimental Properties
- Density: 1.69
- Boiling Point: 365.8°Cat760mmHg
- Flash Point: 175°C
- Refractive Index: 1.717
- PSA: 105.29
- LogP: 1.42690
1H-Imidazole-4-carboxamide,5-[3-(2-chloroethyl)-2-triazen-1-yl]- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
-
Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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