1H-Indazole-7-carboxaldehyde - CAS 312746-72-8
Catalog: |
BB020855 |
Product Name: |
1H-Indazole-7-carboxaldehyde |
CAS: |
312746-72-8 |
Synonyms: |
1H-indazole-7-carboxaldehyde; 1H-indazole-7-carbaldehyde |
IUPAC Name: | 1H-indazole-7-carbaldehyde |
Description: | 1H-Indazole-7-carboxaldehyde (CAS# 312746-72-8) is a useful research chemical. |
Molecular Weight: | 146.15 |
Molecular Formula: | C8H6N2O |
Canonical SMILES: | C1=CC2=C(C(=C1)C=O)NN=C2 |
InChI: | InChI=1S/C8H6N2O/c11-5-7-3-1-2-6-4-9-10-8(6)7/h1-5H,(H,9,10) |
InChI Key: | WSCAEUWXSVHQJM-UHFFFAOYSA-N |
Boiling Point: | 358.34 ℃ at 760 mmHg |
Density: | 1.369 g/cm3 |
LogP: | 1.37540 |
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, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113302175-A | Bicyclic compounds | 20181109 |
KR-20210108367-A | Bicyclic Compounds | 20181109 |
US-2018244627-A1 | Heterocyclic compounds and uses thereof | 20150814 |
WO-2017030938-A1 | Heterocyclic compounds and uses thereof | 20150814 |
US-10723705-B2 | Heterocyclic compounds and uses thereof | 20150814 |
Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.048012819 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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