6-Bromo-3-chloro-1H-indazole - CAS 885271-78-3
Catalog: |
BB038921 |
Product Name: |
6-Bromo-3-chloro-1H-indazole |
CAS: |
885271-78-3 |
Synonyms: |
6-bromo-3-chloro-2H-indazole; 6-bromo-3-chloro-2H-indazole |
IUPAC Name: | 6-bromo-3-chloro-2H-indazole |
Description: | 6-Bromo-3-chloro-1H-indazole (CAS# 885271-78-3) is a useful research chemical. |
Molecular Weight: | 231.48 |
Molecular Formula: | C7H4BrClN2 |
Canonical SMILES: | C1=CC2=C(NN=C2C=C1Br)Cl |
InChI: | InChI=1S/C7H4BrClN2/c8-4-1-2-5-6(3-4)10-11-7(5)9/h1-3H,(H,10,11) |
InChI Key: | LDBXLSQSRZCYHL-UHFFFAOYSA-N |
Boiling Point: | 368.5 °C at 760 mmHg |
Density: | 1.878 g/cm3 |
MDL: | MFCD06738283 |
LogP: | 2.97880 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, 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 |
TW-201945355-A | Condensed cyclic urea derivatives as CRHR2 antagonists | 20180409 |
WO-2019198692-A1 | Fused cyclic urea derivatives as crhr2 antagonist | 20180409 |
CN-111868037-A | Fused cyclic urea derivatives as CRHR2 antagonists | 20180409 |
KR-20200135834-A | Condensed cyclic urea derivatives as CRHR2 antagonists | 20180409 |
BR-112020020708-A2 | CYCLIC UREA FUSED DERIVATIVES AS CRHR2 ANTAGONIST | 20180409 |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.92464 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.92464 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 28.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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