(2,2-Dimethyl-1-propyl)benzene - CAS 1007-26-7
Catalog: |
BB000315 |
Product Name: |
(2,2-Dimethyl-1-propyl)benzene |
CAS: |
1007-26-7 |
Synonyms: |
2,2-dimethylpropylbenzene |
IUPAC Name: | 2,2-dimethylpropylbenzene |
Description: | (2,2-Dimethyl-1-propyl)benzene (CAS# 1007-26-7) is a useful research chemical. |
Molecular Weight: | 148.24 |
Molecular Formula: | C11H16 |
Canonical SMILES: | CC(C)(C)CC1=CC=CC=C1 |
InChI: | InChI=1S/C11H16/c1-11(2,3)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3 |
InChI Key: | CJGXJKVMUHXVHL-UHFFFAOYSA-N |
Boiling Point: | 185-186 °C (lit.) |
Purity: | 95 % |
Density: | 0.858 g/mL at 25°C(lit.) |
Appearance: | Clear colorless liquid |
Storage: | Flammables area |
MDL: | MFCD00038279 |
LogP: | 3.27520 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021323942-A1 | Heterocyclic compounds for modulating nr2f6 | 20200225 |
JP-2021113188-A | Polycyclic aromatic compounds | 20200117 |
JP-2021113160-A | Polycyclic aromatic compounds | 20200116 |
JP-2021103742-A | Organic electroluminescent device | 20191225 |
JP-2021095342-A | Polycyclic aromatic compounds | 20191213 |
PMID | Publication Date | Title | Journal |
22742925 | 20120807 | Adsorption and desorption of mixtures of organic vapors on beaded activated carbon | Environmental science & technology |
21583135 | 20090514 | 1-(4-tert-Butyl-benz-yl)-3-phenyl-1H-pyrazole-5-carboxylic acid | Acta crystallographica. Section E, Structure reports online |
12751816 | 20030201 | 3Beta-sulfamate derivatives of C19 and C21 steroids bearing a t-butylbenzyl or a benzyl group: synthesis and evaluation as non-estrogenic and non-androgenic steroid sulfatase inhibitors | Journal of enzyme inhibition and medicinal chemistry |
11948019 | 20020301 | Nonsteroidal compounds designed to mimic potent steroid sulfatase inhibitors | The Journal of steroid biochemistry and molecular biology |
Complexity: | 102 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.125200510 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.125200510 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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