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598-25-4 | 3-METHYL-1,2-BUTADIENE
CAS No: 598-25-4 Catalog No: AG003JOB MDL No:MFCD00008896
Product Description
Catalog Number:
AG003JOB
Chemical Name:
3-METHYL-1,2-BUTADIENE
CAS Number:
598-25-4
MDL Number:
MFCD00008896
IUPAC Name:
3-methylbuta-1,2-diene
InChI:
InChI=1S/C5H8/c1-4-5(2)3/h1H2,2-3H3
InChI Key:
PAKGDPSCXSUALC-UHFFFAOYSA-N
EC Number:
209-926-1
UNII:
NQO612O389
NSC Number:
74117
Properties
Complexity:
60.1
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
68.063g/mol
Formal Charge:
0
Heavy Atom Count:
5
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
68.119g/mol
Monoisotopic Mass:
68.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
| Title | Journal |
|---|---|
| Antidromic vasodilatation and the migraine mechanism. | The journal of headache and pain 20120301 |
| Vibrational investigation on FT-IR and FT-Raman spectra, IR intensity, Raman activity, peak resemblance, ideal estimation, standard deviation of computed frequencies analyses and electronic structure on 3-methyl-1,2-butadiene using HF and DFT (LSDA/B3LYP/B3PW91) calculations. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20111101 |
| Impact of KRAS, BRAF, PIK3CA mutations, PTEN, AREG, EREG expression and skin rash in ≥ 2 line cetuximab-based therapy of colorectal cancer patients. | PloS one 20110101 |
| Enantioselective carbonyl allylation, crotylation, and tert-prenylation of furan methanols and furfurals via iridium-catalyzed transfer hydrogenation. | The Journal of organic chemistry 20100305 |
| The challenge of metastatic colorectal cancer. | Clinical Medicine Insights. Oncology 20100101 |
| Acid-evoked Ca2+ signalling in rat sensory neurones: effects of anoxia and aglycaemia. | Pflugers Archiv : European journal of physiology 20091101 |
| Protecting-group-free synthesis of 3-tert-prenylated oxindoles: contiguous all-carbon quaternary centers via tertiary neopentyl substitution. | Organic letters 20091015 |
| Biomarkers predicting clinical outcome of epidermal growth factor receptor-targeted therapy in metastatic colorectal cancer. | Journal of the National Cancer Institute 20091007 |
| TRPV3 in keratinocytes transmits temperature information to sensory neurons via ATP. | Pflugers Archiv : European journal of physiology 20091001 |
| Direct prenylation of aromatic and alpha,beta-unsaturated carboxamides via iridium-catalyzed C-H oxidative addition-allene insertion. | Organic letters 20090917 |
| Advances in preclinical therapeutics development using small animal imaging and molecular analyses: the gastrointestinal stromal tumors model. | Clinical and experimental medicine 20090901 |
| HCO 3--dependent volume regulation in alpha-cells of the rat endocrine pancreas. | Pflugers Archiv : European journal of physiology 20090701 |
| Enantioselective carbonyl reverse prenylation from the alcohol or aldehyde oxidation level employing 1,1-dimethylallene as the prenyl donor. | Journal of the American Chemical Society 20090527 |
| Evolving role of cetuximab in the treatment of colorectal cancer. | Cancer management and research 20090101 |
| Identification of pore residues engaged in determining divalent cationic permeation in transient receptor potential melastatin subtype channel 2. | The Journal of biological chemistry 20081010 |
| Iridium-catalyzed hydrocarboxylation of 1,1-dimethylallene: byproduct-free reverse prenylation of carboxylic acids. | Organic letters 20080207 |
| Diversity of Cl(-) channels. | Cellular and molecular life sciences : CMLS 20060101 |
| ATP release via anion channels. | Purinergic signalling 20051201 |
| Unusual palladium-catalyzed silaboration of allenes using organic iodides as initiators: mechanism and application. | Journal of the American Chemical Society 20050112 |
| Highly regio- and stereoselective acylboration, acylsilation, and acylstannation of allenes catalyzed by phosphine-free palladium complexes: an efficient route to a new class of 2-acylallylmetal reagents. | Journal of the American Chemical Society 20031015 |
| Palladium-catalyzed three-component assembling of allenes, organic halides, and arylboronic acids. | The Journal of organic chemistry 20020111 |
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