3-Ethyl-4-iodo-1H-pyrazole - CAS 442876-19-9
Catalog: |
BB025559 |
Product Name: |
3-Ethyl-4-iodo-1H-pyrazole |
CAS: |
442876-19-9 |
Synonyms: |
5-ethyl-4-iodo-1H-pyrazole; 5-ethyl-4-iodo-1H-pyrazole |
IUPAC Name: | 5-ethyl-4-iodo-1H-pyrazole |
Description: | 3-Ethyl-4-iodo-1H-pyrazole (CAS# 442876-19-9) is a useful research chemical compound. |
Molecular Weight: | 222.03 |
Molecular Formula: | C5H7IN2 |
Canonical SMILES: | CCC1=C(C=NN1)I |
InChI: | InChI=1S/C5H7IN2/c1-2-5-4(6)3-7-8-5/h3H,2H2,1H3,(H,7,8) |
InChI Key: | LJHHAGBAOGUEQO-UHFFFAOYSA-N |
LogP: | 1.57670 |
Publication Number | Title | Priority Date |
AU-2018270685-A1 | Novel compounds as autotaxin inhibitors and pharmaceutical compositions comprising the same | 20170517 |
AU-2018270685-B2 | Novel compounds as autotaxin inhibitors and pharmaceutical compositions comprising the same | 20170517 |
AU-2020203594-A1 | Novel compounds as autotaxin inhibitors and pharmaceutical compositions comprising the same | 20170517 |
CA-3019980-A1 | Novel compounds as autotaxin inhibitors and pharmaceutical compositions comprising the same | 20170517 |
EP-3442973-A1 | Novel compounds as autotaxin inhibitors and pharmaceutical compositions comprising the same | 20170517 |
Complexity: | 76.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.9654 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.9654 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 28.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Pyrazoles
Customers Also Viewed
-
[2093414-16-3]
1,1'-Bis[3-(trimethylammonio)propyl]ferrocene dichloride
-
[137076-54-1]
DOTA-tris(tert-butyl ester)
-
[1388152-02-0]
1,2-Cyclopentanediol, 3-amino-5-[(phosphonooxy)methy]-, ammonium salt (1:2), (1R,2S,3R,5R)-
-
[6982-39-4]
trans-2-Aminocyclohexanol
-
[70684-84-3]
1-Boc-1,2,3,6-tetrahydropyridine-4-carboxylic Acid
-
[34374-88-4]
2,4,6-Trihydroxybenzene-1,3,5-tricarbaldehyde
INDUSTRY LEADERS TRUST OUR PRODUCTS