Cas no 321309-44-8 (Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)-)
321309-44-8 structure
Product Name:Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)-
CAS No:321309-44-8
MF:C9H6N2OS
MW:190.221740245819
CID:303526
PubChem ID:2776453
Update Time:2025-04-19
Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)-
- 4-(1,2,3-THIADIAZOL-4-YL)BENZALDEHYDE
- 4-(thiadiazol-4-yl)benzaldehyde
- 4-(4-thiadiazolyl)benzaldehyde
- DTXSID00380091
- MFCD00207726
- A821153
- SCHEMBL3502448
- 4-[1,2,3]thiadiazol-4-yl-benzaldehyde
- KCYKKBNXHITUOU-UHFFFAOYSA-N
- FT-0616439
- 4-(1,2,3-thiadiazol-4-yl)benzaldehyde, AldrichCPR
- 321309-44-8
-
- Inchi： 1S/C9H6N2OS/c12-5-7-1-3-8(4-2-7)9-6-13-11-10-9/h1-6H
- InChI Key： KCYKKBNXHITUOU-UHFFFAOYSA-N
- SMILES： S1C=C(C2C=CC(C=O)=CC=2)N=N1
Computed Properties
- Exact Mass: 190.02000
- Monoisotopic Mass: 190.02
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 181
- 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: 1.9
- Topological Polar Surface Area: 71.1?2
Experimental Properties
- Density: 1.336
- Boiling Point: 363°Cat760mmHg
- Flash Point: 173.3°C
- Refractive Index: 1.654
- PSA: 71.09000
- LogP: 2.01760
Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)- Security Information
- Hazard Category Code： 36/37/38-22
- Safety Instruction： S26; S36/37/39
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Hazardous Material Identification：
- Risk Phrases：R36/37/38
- Safety Term：S24/25
Benzaldehyde,4-(1,2,3-thiadiazol-4-yl)- Related Literature
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1. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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