2-Chloro-1,3-dimethylbenzene - CAS 6781-98-2
Catalog: |
BB033405 |
Product Name: |
2-Chloro-1,3-dimethylbenzene |
CAS: |
6781-98-2 |
Synonyms: |
2-chloro-1,3-dimethylbenzene |
IUPAC Name: | 2-chloro-1,3-dimethylbenzene |
Description: | 2-Chloro-1,3-dimethylbenzene (CAS# 6781-98-2) is a useful research chemical. |
Molecular Weight: | 140.61 |
Molecular Formula: | C8H9Cl |
Canonical SMILES: | CC1=C(C(=CC=C1)C)Cl |
InChI: | InChI=1S/C8H9Cl/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3 |
InChI Key: | VDXLAYAQGYCQEO-UHFFFAOYSA-N |
Boiling Point: | 182-183 °C |
Density: | 1.061 g/cm3 |
MDL: | MFCD00000565 |
LogP: | 2.95680 |
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-113248396-A | Preparation method of chlorobenzene para-aminated compound mediated by high-valence iodine reagent | 20210525 |
WO-2021110009-A1 | Novel aurora kinase inhibitor and use thereof | 20191203 |
CN-110818545-A | Method for preparing substituted aryl ketone by ketone arylation | 20191123 |
CN-110922286-A | Asymmetric aryl substituted fulvene compound and preparation method and application thereof | 20191123 |
CN-110590590-A | 1A1/5Lidocaine hydrochloride hydrate compound | 20191018 |
PMID | Publication Date | Title | Journal |
15054800 | 20040326 | A rationally designed universal catalyst for Suzuki-Miyaura coupling processes | Angewandte Chemie (International ed. in English) |
Complexity: | 80.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.0392780 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.0392780 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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