4-Iodo-1-(phenylmethoxy)-1H-pyrazole - CAS 229171-07-7
Catalog: |
BB060694 |
Product Name: |
4-Iodo-1-(phenylmethoxy)-1H-pyrazole |
CAS: |
229171-07-7 |
Synonyms: |
1-(Benzyloxy)-4-iodo-1H-pyrazole; 1-(Benzyloxy)-4-iodopyrazole; 4-iodo-1-phenylmethoxypyrazole; 1H-Pyrazole, 4-iodo-1-(phenylmethoxy)-; 4-Iodo-1-(phenylmethoxy)-1H-pyrazole; 1-Benzyloxy-4-iodo-1H-pyrazole; N-benzyloxy-4-iodopyrazole |
IUPAC Name: | 4-iodo-1-phenylmethoxypyrazole |
Description: | 4-Iodo-1-(phenylmethoxy)-1H-pyrazole, can be used in the preparation of some Amines and Amino Acids containing the Pyrazole nucleus. It is an intermediate in the synthesis of 1-Hydroxypyrazole as a bioisostere of the acetic acid moiety in a series of aldose reductase inhibitors. |
Molecular Weight: | 300.1 |
Molecular Formula: | C10H9IN2O |
Canonical SMILES: | C1=CC=C(C=C1)CON2C=C(C=N2)I |
InChI: | InChI=1S/C10H9IN2O/c11-10-6-12-13(7-10)14-8-9-4-2-1-3-5-9/h1-7H,8H2 |
InChI Key: | VLRXSAMTKJXSPK-UHFFFAOYSA-N |
References: | Papastavrou, N., et al. Bioorg. Med. Chem., 21, 4951 (2013). |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.97596 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.97596 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 27Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
-
Catalog: BB071775
((1R,4R)-4-(((tert-butyldimethylsilyl)oxy)methyl)cyclohexyl)methanol
Detail
-
Catalog: BB074213
((2R,3S,4R,5R,6R)-5-Acetamido-3,4-dihydroxy-6-(2-(trimethylsilyl)ethoxy)tetrahydro-2H-pyran-2-yl)methyl 4-Methylbenzenesulfonate
Detail
-
Catalog: BB069926
((2R,4R)-2-(Chloromethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-Methylbenzenesulfonate
Detail
-
Catalog: BB069924
((2S,4S)-2-(Chloromethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-Methylbenzenesulfonate
Detail
-
Catalog: BB069173
((1-Chloro-2-methylpropan-2-yl)oxy)trimethylsilane
Detail
-
Catalog: BB061033
((2R,5S,10aS,10bS)-10b-Hydroxy-5-isopropyl-2-methyl-3,6-dioxooctahydro-2H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)carbamic Acid Benzyl Ester
Detail
-
Catalog: BB074488
((1R,3R)-3-Amino-cyclopentyl)-carbamic Acid tert-Butyl Ester
Detail
-
Catalog: BB067784
((1R,2R)-2-(2,3-Dihydrobenzofuran-4-yl)cyclopropyl)methanamine
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS