4-Ethynyl-4'-Propyl-1,1'-Biphenyl - CAS 360768-57-6
Catalog: |
BB053914 |
Product Name: |
4-Ethynyl-4'-Propyl-1,1'-Biphenyl |
CAS: |
360768-57-6 |
Synonyms: |
4-Ethynyl-4'-propylbiphenyl; 4-Propyl-4'-ethynylbiphenyl |
IUPAC Name: | 1-ethynyl-4-(4-propylphenyl)benzene |
Molecular Weight: | 220.31 |
Molecular Formula: | C17H16 |
Canonical SMILES: | CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#C |
InChI: | InChI=1S/C17H16/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16/h2,6-13H,3,5H2,1H3 |
InChI Key: | ZBSZCHDBZRCUES-UHFFFAOYSA-N |
Boiling Point: | 332.8±31.0 °C / 760 mmHg |
Purity: | >98% by GC |
Appearance: | White to Orange Powder |
Storage: | Sealed in dry. Keep cold. |
MDL: | MFCD18072535 |
Precautionary Statement: | P261-P305+P351+P338 |
Signal Word: | Warning |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.12520051 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.12520051 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.1 |
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