3-(5-Bromo-1H-1,2,4-triazol-1-yl)propanoic acid - CAS 1855889-75-6
Catalog: |
BB050778 |
Product Name: |
3-(5-Bromo-1H-1,2,4-triazol-1-yl)propanoic acid |
CAS: |
1855889-75-6 |
Synonyms: |
1H-1,2,4-Triazole-1-propanoic acid, 5-bromo-; 3-(5-Bromo-[1,2,4]triazol-1-yl)-propionic acid |
IUPAC Name: | 3-(5-bromo-1,2,4-triazol-1-yl)propanoic acid |
Molecular Weight: | 220.02 |
Molecular Formula: | C5H6BrN3O2 |
Canonical SMILES: | C1=NN(C(=N1)Br)CCC(=O)O |
InChI: | InChI=1S/C5H6BrN3O2/c6-5-7-3-8-9(5)2-1-4(10)11/h3H,1-2H2,(H,10,11) |
InChI Key: | BLLWWHMPZVZCIW-UHFFFAOYSA-N |
Boiling Point: | 436.3±47.0°C at 760 mmHg |
Purity: | ≥95% |
Density: | 2.0±0.1 g/cm3 |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 218.96434 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 218.96434 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 68 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
-
Catalog: BB013950
2-[2-(propan-2-yl)-2H-1,2,3-triazol-4-yl]acetic acid
Detail
-
Catalog: BB014240
5-[(Benzyloxy)methyl]-2H-tetrazole
Detail
-
Catalog: BB015548
1-(5-Bromopentyl)-1,2,3-triazole
Detail
-
Catalog: BB002424
5-(4-Fluoro-3-methoxyphenyl)-2H-tetrazole
Detail
-
Catalog: BB005032
1-(1-Methyl-1H-1,2,4-triazol-5-yl)ethanamine
Detail
-
Catalog: BB004259
5-Tetrazolemethanamine Hydrochloride
Detail
-
Catalog: BB013559
1-(4-Bromobutyl)-1,2,3-triazole
Detail
-
Catalog: BB009427
5-Bromo-1,2,4-triazole-3-carbonitrile
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Halides
Triazole/Tetrazole
-
[828291-81-2]
5-(3-((2-Bromophenoxy)methyl)phenyl)-4-ethyl-4H-1,2,4-triazole-3-thiol
-
[1005680-56-7]
Ethyl ({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-YL]-4H-1,2,4-triazol-3-YL}thio)acetate
-
[1243250-13-6]
Ethyl (3-bromo-1H-1,2,4-triazol-1-yl)acetate
-
[91616-41-0]
ethyl 1-methyl-1H-1,2,3,4-tetrazole-5-carboxylate
-
[86152-46-7]
Ethyl 2-(5-amino-4H-1,2,4-triazol-3-yl)acetate
-
[1823421-51-7]
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)butanoate
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS