9-methyl-9,9a-dihydro-4aH-carbazole-3-carbaldehyde - CAS 1443278-76-9
Catalog: |
BB052323 |
Product Name: |
9-methyl-9,9a-dihydro-4aH-carbazole-3-carbaldehyde |
CAS: |
1443278-76-9 |
Synonyms: |
9-methyl-9,9a-dihydro-4aH-carbazole-3-carbaldehyde |
IUPAC Name: | 9-methyl-4a,9a-dihydrocarbazole-3-carbaldehyde |
Molecular Weight: | 211.26 |
Molecular Formula: | C14H13NO |
Canonical SMILES: | CN1C2C=CC(=CC2C3=CC=CC=C31)C=O |
InChI: | InChI=1S/C14H13NO/c1-15-13-5-3-2-4-11(13)12-8-10(9-16)6-7-14(12)15/h2-9,12,14H,1H3 |
InChI Key: | PYFGQYUCBXXFMR-UHFFFAOYSA-N |
Complexity: | 358 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 211.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 211.099714038 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.3 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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