Cas no 21244-73-5 ((4Z)-4-(3-propyltriazanylidene)-4H-imidazole-5-carboxamide hydrochloride (1:1))
21244-73-5 structure
Product Name:(4Z)-4-(3-propyltriazanylidene)-4H-imidazole-5-carboxamide hydrochloride (1:1)
CAS No:21244-73-5
MF:C7H13ClN6O
MW:232.67071890831
CID:1399660
PubChem ID:210417
Update Time:2025-04-20
(4Z)-4-(3-propyltriazanylidene)-4H-imidazole-5-carboxamide hydrochloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- (4Z)-4-(3-propyltriazanylidene)-4H-imidazole-5-carboxamide hydrochloride (1:1)
- LogP
- (5Z)-5-(propylaminohydrazinylidene)imidazole-4-carboxamide,hydrochloride
- Imidazole-4-carboxamide, 5-(3-propyl-1-triazeno)-
- 21244-73-5
- 5-(3-Propyl-1-triazeno)-1H-imidazole-4-carboxamide
-
- Inchi： 1S/C7H12N6O.ClH/c1-2-3-11-13-12-7-5(6(8)14)9-4-10-7;/h4H,2-3H2,1H3,(H2,8,14)(H,9,10)(H,11,12);1H
- InChI Key： IWQRFLHACYTHCR-UHFFFAOYSA-N
- SMILES： Cl.O=C(C1=C(N=CN1)N/N=N/CCC)N
Computed Properties
- Exact Mass: 232.08419
- Monoisotopic Mass: 232.0839368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 218
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 105.29
(4Z)-4-(3-propyltriazanylidene)-4H-imidazole-5-carboxamide hydrochloride (1:1) Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Jason Wan Lab Chip, 2020,20, 4528-4538
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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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