1-Phenyl-1-propyne - CAS 673-32-5
Catalog: |
BB033250 |
Product Name: |
1-Phenyl-1-propyne |
CAS: |
673-32-5 |
Synonyms: |
Benzene, 1-propyn-1-yl-; 1-Propyn-1-ylbenzene; Benzene, (1-propynyl)-; Benzene, 1-propynyl-; Propine, 1-phenyl-; Propyne, 1-phenyl-; (2-Methylethynyl)benzene; 1-Methyl-2-phenylacetylene; 1-Phenylpropyne; 1-Propynylbenzene; 3-Phenyl-2-propyne; Methylphenylacetylene; Methylphenylethyne; Phenylmethylacetylene |
IUPAC Name: | prop-1-ynylbenzene |
Description: | 1-Phenyl-1-propyne (CAS# 673-32-5) is a useful research chemical. |
Molecular Weight: | 116.16 |
Molecular Formula: | C9H8 |
Canonical SMILES: | CC#CC1=CC=CC=C1 |
InChI: | InChI=1S/C9H8/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,1H3 |
InChI Key: | GHUURDQYRGVEHX-UHFFFAOYSA-N |
Boiling Point: | 183°C |
Melting Point: | 90°C |
Purity: | ≥95% |
Density: | 0.9409 g/cm3 |
Solubility: | Soluble in Water (Sparingly) |
Appearance: | Clear Yellow Liquid |
Storage: | Store at 2-8°C |
MDL: | MFCD00009272 |
LogP: | 2.05800 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113368870-A | Sulfur ligand modified monoatomic catalyst and preparation method and application thereof | 20210709 |
CN-113480396-A | Method for synthesizing cis-olefin by selective semi-hydrogenation | 20210617 |
CN-113248458-A | Preparation method of alpha-carbonyl amide compound | 20210527 |
CN-113149926-A | Preparation method of 3, 5-disubstituted isoxazole derivative | 20210430 |
CN-113121427-A | Quinoline derivative and preparation method and application thereof | 20210319 |
PMID | Publication Date | Title | Journal |
22830569 | 20120823 | Phenylpropargyl radicals and their dimerization products: an IR/UV double resonance study | The journal of physical chemistry. A |
20593856 | 20100729 | Ab initio/RRKM-ME study on the mechanism and kinetics of the reaction of phenyl radical with 1,2-butadiene | The journal of physical chemistry. A |
19813740 | 20100415 | Photoionization of three isomers of the C9H7 radical | The journal of physical chemistry. A |
19053235 | 20090217 | Reaction dynamics of phenyl radicals in extreme environments: a crossed molecular beam study | Accounts of chemical research |
18973349 | 20081118 | Cross-coupling reaction of alkyl halides with grignard reagents catalyzed by Ni, Pd, or Cu complexes with pi-carbon ligand(s) | Accounts of chemical research |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 116.062600255 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 116.062600255 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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