3-Bromo-4-[2-(piperidino)ethoxy]benzaldehyde - CAS 938370-87-7
Catalog: |
BB071523 |
Product Name: |
3-Bromo-4-[2-(piperidino)ethoxy]benzaldehyde |
CAS: |
938370-87-7 |
Synonyms: |
3-Bromo-4-[2-(1-piperidinyl)ethoxy]-benzaldehyde |
IUPAC Name: | 3-bromo-4-(2-piperidin-1-ylethoxy)benzaldehyde |
Description: | 3-Bromo-4-[2-(piperidino)ethoxy]benzaldehyde |
Molecular Weight: | 312.2 |
Molecular Formula: | C14H18BrNO2 |
Canonical SMILES: | C1CCN(CC1)CCOC2=C(C=C(C=C2)C=O)Br |
InChI: | InChI=1S/C14H18BrNO2/c15-13-10-12(11-17)4-5-14(13)18-9-8-16-6-2-1-3-7-16/h4-5,10-11H,1-3,6-9H2 |
InChI Key: | LYMCTSKYDFSRQS-UHFFFAOYSA-N |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 311.05209 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 311.05209 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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