3-Chloro-4-methylphenol - CAS 615-62-3
Catalog: |
BB031180 |
Product Name: |
3-Chloro-4-methylphenol |
CAS: |
615-62-3 |
Synonyms: |
3-chloro-4-methylphenol |
IUPAC Name: | 3-chloro-4-methylphenol |
Description: | 3-Chloro-4-methylphenol (CAS# 615-62-3) is used in preparation of (Carbonyl)benzylthiadiazoles as herbicides. |
Molecular Weight: | 142.58 |
Molecular Formula: | C7H7ClO |
Canonical SMILES: | CC1=C(C=C(C=C1)O)Cl |
InChI: | InChI=1S/C7H7ClO/c1-5-2-3-6(9)4-7(5)8/h2-4,9H,1H3 |
InChI Key: | VQZRLBWPEHFGCD-UHFFFAOYSA-N |
Boiling Point: | 228 ℃ |
Melting Point: | 55 ℃ |
Purity: | 95 % |
Density: | 0.963 g/cm3 |
MDL: | MFCD00060319 |
LogP: | 2.35400 |
GHS Hazard Statement: | H302 (97.92%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021071806-A1 | Arylmethylene heterocyclic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
WO-2021071832-A1 | Aryl heterobicyclic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
WO-2020195819-A1 | Method for manufacturing optical film and optical film | 20190326 |
WO-2020162418-A1 | Colorless transparent polyimide film | 20190204 |
WO-2020120528-A1 | N-containing chromen-4-one derivatives for the treatment and prophylaxis of hepatitis b virus infection | 20181214 |
Complexity: | 94.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.0185425 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.0185425 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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