3-Iodo-1-methyl-1H-indazole - CAS 52088-10-5
Catalog: |
BB027703 |
Product Name: |
3-Iodo-1-methyl-1H-indazole |
CAS: |
52088-10-5 |
Synonyms: |
3-iodo-1-methylindazole; 3-iodo-1-methylindazole |
IUPAC Name: | 3-iodo-1-methylindazole |
Description: | 3-Iodo-1-methyl-1H-indazole (CAS# 52088-10-5) is a useful research chemical. |
Molecular Weight: | 258.06 |
Molecular Formula: | C8H7IN2 |
Canonical SMILES: | CN1C2=CC=CC=C2C(=N1)I |
InChI: | InChI=1S/C8H7IN2/c1-11-7-5-3-2-4-6(7)8(9)10-11/h2-5H,1H3 |
InChI Key: | OAQYCAYEBWRHLC-UHFFFAOYSA-N |
Boiling Point: | 318.4 °C at 760 mmHg |
Density: | 1.89 g/cm3 |
LogP: | 2.17790 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020119739-A1 | 2-aminopyrimidine compound and application therefor | 20181212 |
US-2019210973-A1 | Compounds and methods for treatment of cystic fibrosis | 20180105 |
WO-2019136314-A1 | Compounds and methods for treatment of cystic fibrosis | 20180105 |
EP-3686196-A1 | Polycyclic compound acting as ido inhibitor and/or ido-hdac dual inhibitor | 20170920 |
WO-2017096045-A1 | Multivalent ras binding compounds | 20151202 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.96540 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.96540 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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