2,5-Dimethylbenzyl chloride - CAS 824-45-3
Catalog: |
BB036831 |
Product Name: |
2,5-Dimethylbenzyl chloride |
CAS: |
824-45-3 |
Synonyms: |
2-(chloromethyl)-1,4-dimethylbenzene |
IUPAC Name: | 2-(chloromethyl)-1,4-dimethylbenzene |
Description: | 2,5-Dimethylbenzyl chloride (CAS# 824-45-3) is a useful research chemical. |
Molecular Weight: | 154.64 |
Molecular Formula: | C9H11Cl |
Canonical SMILES: | CC1=CC(=C(C=C1)C)CCl |
InChI: | InChI=1S/C9H11Cl/c1-7-3-4-8(2)9(5-7)6-10/h3-5H,6H2,1-2H3 |
InChI Key: | PECXPZGFZFGDRD-UHFFFAOYSA-N |
Boiling Point: | 221-226 °C |
Purity: | 95 % |
Density: | 1.046 g/cm3 |
Appearance: | Clear colorless liquid |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Corrosives area. |
MDL: | MFCD00000902 |
LogP: | 3.04220 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-212492907-U | Reaction device for preparing 2, 5-disubstituted benzonitrile | 20200430 |
CN-111362776-A | Improved preparation method of 2, 5-disubstituted benzyl chloride | 20200425 |
KR-20210101082-A | (arylmethyl)arenes and a production process thereof | 20200207 |
US-2021188739-A1 | Method for producing arene compounds and arene compounds produced by the same | 20191220 |
CN-111072470-A | Method for preparing 2, 5-dimethyl phenylacetyl chloride | 20191218 |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.0549280 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.0549280 |
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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