5-Chloro-1,3-dimethoxybenzene - CAS 7051-16-3
Catalog: |
BB034164 |
Product Name: |
5-Chloro-1,3-dimethoxybenzene |
CAS: |
7051-16-3 |
Synonyms: |
1-chloro-3,5-dimethoxybenzene |
IUPAC Name: | 1-chloro-3,5-dimethoxybenzene |
Description: | 5-Chloro-1,3-dimethoxybenzene (CAS# 7051-16-3) is a useful research chemical. |
Molecular Weight: | 172.61 |
Molecular Formula: | C8H9ClO2 |
Canonical SMILES: | COC1=CC(=CC(=C1)Cl)OC |
InChI: | InChI=1S/C8H9ClO2/c1-10-7-3-6(9)4-8(5-7)11-2/h3-5H,1-2H3 |
InChI Key: | WQHNWJBSROXROL-UHFFFAOYSA-N |
Boiling Point: | 238.2 ℃ at 760 mmHg |
Melting Point: | 34-36 ℃ |
Flash Point: | 234 °F |
Purity: | > 97.0 % (GC) |
Density: | 1.155 g/cm3 |
Appearance: | White to yellow or pink crystalline powder |
MDL: | MFCD00008382 |
LogP: | 2.35720 |
Refractive Index: | 1.5100 (estimate) |
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-113264837-A | Energetic ionic salt of 3, 5-dihydroxy-2, 4, 6-trinitrobenzene derivative and preparation method thereof | 20210528 |
CN-113072575-A | Preparation method of aromatic silicon organic compound | 20210329 |
CN-112159414-A | Nitrogen-containing compound, electronic component, and electronic device | 20201028 |
CN-113054253-A | Overcharge-proof electrolyte of lithium ion battery | 20191229 |
CN-110818545-A | Method for preparing substituted aryl ketone by ketone arylation | 20191123 |
PMID | Publication Date | Title | Journal |
12868934 | 20030725 | Formal synthesis of angiogenesis inhibitor NM-3 | The Journal of organic chemistry |
Complexity: | 107 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.0291072 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.0291072 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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