200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1823-14-9
1823-14-9 | Benzene, 4-pentyn-1-yl-
CAS No: 1823-14-9 Catalog No: AG0023LN MDL No:MFCD00039813
Product Description
Catalog Number:
AG0023LN
Chemical Name:
Benzene, 4-pentyn-1-yl-
CAS Number:
1823-14-9
Molecular Formula:
C11H12
Molecular Weight:
144.2130
MDL Number:
MFCD00039813
IUPAC Name:
pent-4-ynylbenzene
InChI:
InChI=1S/C11H12/c1-2-3-5-8-11-9-6-4-7-10-11/h1,4,6-7,9-10H,3,5,8H2
InChI Key:
KOSORCNALVBYBP-UHFFFAOYSA-N
SMILES:
CCCC#Cc1ccccc1
EC Number:
217-352-8
UNII:
B4QV76Z86Q
NSC Number:
102794
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.217g/mol
Monoisotopic Mass:
144.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Detection of phenolic metabolites of styrene in mouse liver and lung microsomal incubations. | Drug metabolism and disposition: the biological fate of chemicals 20101101 |
| In vitro metabolism and covalent binding of ethylbenzene to microsomal protein as a possible mechanism of ethylbenzene-induced mouse lung tumorigenesis. | Regulatory toxicology and pharmacology : RTP 20100101 |
| Upper respiratory tract uptake of naphthalene. | Toxicological sciences : an official journal of the Society of Toxicology 20091001 |
| Naphthalene toxicity in mice and aryl hydrocarbon receptor-mediated CYPs. | Biochemical and biophysical research communications 20060915 |
| Cytochrome p450 enzymes mechanism based inhibitors: common sub-structures and reactivity. | Current drug metabolism 20051001 |
| Conformation-specific spectroscopy of 4-phenyl-1-butyne and 5-phenyl-1-pentyne. | The journal of physical chemistry. A 20050929 |
| Conformation-specific spectroscopy of 3-benzyl-1,5-hexadiyne. | The journal of physical chemistry. A 20050929 |
| Bioactivation of 1,1-dichloroethylene by CYP2E1 and CYP2F2 in murine lung. | The Journal of pharmacology and experimental therapeutics 20040901 |
| Influence of selected inhibitors on the metabolism of the styrene metabolite 4-vinylphenol in wild-type and CYP2E1 knockout mice. | Journal of toxicology and environmental health. Part A 20040625 |
| Benzene metabolism in human lung cell lines BEAS-2B and A549 and cells overexpressing CYP2F1. | Journal of biochemical and molecular toxicology 20040101 |
| Synthesis of annulated gamma-carbolines and heteropolycycles by the palladium-catalyzed intramolecular annulation of alkynes. | The Journal of organic chemistry 20030627 |
| Effect of the inhibition of the metabolism of 4-vinylphenol on its hepatotoxicity and pneumotoxicity in rats and mice. | Toxicology 20020930 |
| Styrene respiratory tract toxicity and mouse lung tumors are mediated by CYP2F-generated metabolites. | Regulatory toxicology and pharmacology : RTP 20020601 |
| Identification of the cytochromes P450 that catalyze coumarin 3,4-epoxidation and 3-hydroxylation. | Drug metabolism and disposition: the biological fate of chemicals 20020501 |
| The role of cytochromes P-450 in styrene induced pulmonary toxicity and carcinogenicity. | Toxicology 20011214 |
| The toxicity of styrene to the nasal epithelium of mice and rats: studies on the mode of action and relevance to humans. | Chemico-biological interactions 20010831 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.