5-Chloro-1-phenyl-1H-tetrazole - CAS 14210-25-4
Catalog: |
BB009296 |
Product Name: |
5-Chloro-1-phenyl-1H-tetrazole |
CAS: |
14210-25-4 |
Synonyms: |
5-chloro-1-phenyltetrazole |
IUPAC Name: | 5-chloro-1-phenyltetrazole |
Description: | 5-Chloro-1-phenyl-1H-tetrazole (CAS# 14210-25-4) is used as a reactant in the preparation of biaryls via phosphine-catalyzed Suzuki-Miyaura coupling of aryl halides with arylboronic acids. |
Molecular Weight: | 180.59 |
Molecular Formula: | C7H5ClN4 |
Canonical SMILES: | C1=CC=C(C=C1)N2C(=NN=N2)Cl |
InChI: | InChI=1S/C7H5ClN4/c8-7-9-10-11-12(7)6-4-2-1-3-5-6/h1-5H |
InChI Key: | DHELIGKVOGTMGF-UHFFFAOYSA-N |
Boiling Point: | 335.8 °C at 760 mmHg |
Density: | 1.47 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00003128 |
LogP: | 1.31570 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021065898-A1 | Azepan derivative | 20190930 |
CN-110627736-A | Method for recycling 1-phenyl-5-hydroxy tetrazole | 20190926 |
CN-110627736-B | Method for recycling 1-phenyl-5-hydroxy tetrazole | 20190926 |
WO-2020240266-A1 | New endoperoxide compounds, process for obtaining them and uses thereof for control of perkinsiosis in bivalves | 20190531 |
WO-2019173123-A1 | Methods and compositions to reduce azoles and aox corrosion inhibitors | 20180308 |
PMID | Publication Date | Title | Journal |
21837039 | 20110701 | 5-Chloro-1-phenyl-1H-tetra-zole | Acta crystallographica. Section E, Structure reports online |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.0202739 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.0202739 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
-
Catalog: BB016680
5-(5-Bromo-3-pyridyl)-1H-tetrazole
Detail
-
Catalog: BB010432
1-methyl-1H-1,2,3-triazole-5-sulfonyl chloride
Detail
-
Catalog: BB016679
5-(5-Bromo-2-thienyl)-1H-tetrazole solution
Detail
-
Catalog: BB005033
5-Bromo-3-(methoxymethyl)-1H-1,2,4-triazole
Detail
-
Catalog: BB005032
1-(1-Methyl-1H-1,2,4-triazol-5-yl)ethanamine
Detail
-
Catalog: BB015548
1-(5-Bromopentyl)-1,2,3-triazole
Detail
-
Catalog: BB013491
3,5-Dibromo-1-(methoxymethyl)-1H-1,2,4-triazole
Detail
-
Catalog: BB013559
1-(4-Bromobutyl)-1,2,3-triazole
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Triazole/Tetrazole
-
[1855888-97-9]
N-Benzyl-1-(1-ethyl-1H-1,2,4-triazol-5-yl)methanamine dihydrochloride
-
[6926-51-8]
5-(4-Methoxyphenyl)-2H-tetrazole
-
[1005680-56-7]
Ethyl ({4-ethyl-5-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-3-YL]-4H-1,2,4-triazol-3-YL}thio)acetate
-
[1823402-86-3]
Ethyl 2-(3-bromo-1H-1,2,4-triazol-1-yl)propanoate
-
[1823402-59-0]
Ethyl 2-(5-bromo-1H-1,2,4-triazol-1-yl)butanoate
-
[1823421-51-7]
Ethyl 2-(5-chloro-1H-1,2,4-triazol-1-yl)butanoate
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS