4-(1-Benzyl-4-piperidylidene)-2-buten-1-ol - CAS 1408229-29-7
Catalog: |
BB009132 |
Product Name: |
4-(1-Benzyl-4-piperidylidene)-2-buten-1-ol |
CAS: |
1408229-29-7 |
Synonyms: |
(E)-4-[1-(phenylmethyl)-4-piperidinylidene]-2-buten-1-ol; (E)-4-(1-benzylpiperidin-4-ylidene)but-2-en-1-ol |
IUPAC Name: | (E)-4-(1-benzylpiperidin-4-ylidene)but-2-en-1-ol |
Description: | 4-(1-Benzyl-4-piperidylidene)-2-buten-1-ol (CAS# 1408229-29-7 ) is a useful research chemical. |
Molecular Weight: | 243.34 |
Molecular Formula: | C16H21NO |
Canonical SMILES: | C1CN(CCC1=CC=CCO)CC2=CC=CC=C2 |
InChI: | InChI=1S/C16H21NO/c18-13-5-4-6-15-9-11-17(12-10-15)14-16-7-2-1-3-8-16/h1-8,18H,9-14H2/b5-4+ |
InChI Key: | WHNOLOCULOSWCX-SNAWJCMRSA-N |
Storage: | Keep in dark place, Inert atmosphere, 2-8 ℃ |
LogP: | 2.69520 |
Complexity: | 280 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 243.162314293 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 243.162314293 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 23.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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