Cas no 80945-66-0 (Benzothiazole,2-hydrazinyl-5-methyl-)
80945-66-0 structure
Product Name:Benzothiazole,2-hydrazinyl-5-methyl-
CAS No:80945-66-0
MF:C8H9N3S
MW:179.242159605026
CID:707924
PubChem ID:10702501
Update Time:2025-04-19
Benzothiazole,2-hydrazinyl-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole,2-hydrazinyl-5-methyl-
- 2(3H)-Benzothiazolone,5-methyl-,hydrazone(9CI)
- 5-methyl-2-hydrazinobenzothiazole
- 6-Methyl-2-oxo-2H-pyrido<1,2-a>pyrimidin
- AKOS002391397
- (5-Methyl-benzothiazol-2-yl)-hydrazine
- (Z)-2-Hydrazono-5-methyl-2,3-dihydrobenzo[d]thiazole
- 2(3H)-Benzothiazolone, 5-methyl-, hydrazone
- BB 0246267
- AKOS006327317
- SCHEMBL11198073
- 80945-66-0
- SCHEMBL2138878
-
- Inchi: 1S/C8H9N3S/c1-5-2-3-7-6(4-5)10-8(11-9)12-7/h2-4H,9H2,1H3,(H,10,11)
- InChI Key: WPVGYMPMOXIOTQ-UHFFFAOYSA-N
- SMILES: S1C(NN)=NC2C=C(C)C=CC1=2
Computed Properties
- Exact Mass: 179.05200
- Monoisotopic Mass: 179.05171847g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 164
- 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: 2.3
- Topological Polar Surface Area: 79.2?2
Experimental Properties
- PSA: 82.41000
- LogP: 2.01250
Benzothiazole,2-hydrazinyl-5-methyl- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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