6-Iodo-1H-indole-3-carbaldehyde - CAS 115666-25-6
Catalog: |
BB044532 |
Product Name: |
6-Iodo-1H-indole-3-carbaldehyde |
CAS: |
115666-25-6 |
Synonyms: |
1H-Indole-3-carboxaldehyde, 6-iodo-; 6-iodo-3-indolecarboxaldehyde |
IUPAC Name: | 6-iodo-1H-indole-3-carbaldehyde |
Description: | 6-Iodo-1H-indole-3-carbaldehyde (CAS# 115666-25-6 ) is a useful research chemical. |
Molecular Weight: | 271.05 |
Molecular Formula: | C9H6INO |
Canonical SMILES: | C1=CC2=C(C=C1I)NC=C2C=O |
InChI: | InChI=1S/C9H6INO/c10-7-1-2-8-6(5-12)4-11-9(8)3-7/h1-5,11H |
InChI Key: | MEESOKSOKCJRIG-UHFFFAOYSA-N |
Boiling Point: | 417.6±25.0 °C at 760 mmHg |
Purity: | ≥ 95 % by HPLC |
Density: | 1.998±0.06 g/cm3 |
Complexity: | 185 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 270.94941 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 270.94941 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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