3-Chlorobenzyl alcohol - CAS 873-63-2
Catalog: |
BB038403 |
Product Name: |
3-Chlorobenzyl alcohol |
CAS: |
873-63-2 |
Synonyms: |
(3-chlorophenyl)methanol |
IUPAC Name: | (3-chlorophenyl)methanol |
Description: | 3-Chlorobenzyl alcohol (CAS# 873-63-2) is a useful research chemical. |
Molecular Weight: | 142.58 |
Molecular Formula: | C7H7ClO |
Canonical SMILES: | C1=CC(=CC(=C1)Cl)CO |
InChI: | InChI=1S/C7H7ClO/c8-7-3-1-2-6(4-7)5-9/h1-4,9H,5H2 |
InChI Key: | ZSRDNPVYGSFUMD-UHFFFAOYSA-N |
Boiling Point: | 237 °C |
Purity: | 98 % |
Density: | 1.21 g/cm3 |
Appearance: | Clear liquid |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00004632 |
LogP: | 1.83230 |
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-113480394-A | Green synthesis method of alkylene fluorene | 20210705 |
CN-113214104-A | Method for synthesizing aromatic acetamide | 20210416 |
CN-113087673-A | Preparation method of alkyl/alkenyl substituted nitrogen-containing heterocyclic compound | 20210407 |
CN-112574081-A | Process for preparing arylthioamide compounds | 20201212 |
CN-112047816-A | Method for synthesizing ether by catalyzing alcohol with trimethylhalosilane | 20200923 |
PMID | Publication Date | Title | Journal |
22018876 | 20111201 | Synthesis and inhibition study of monoamine oxidase, indoleamine 2,3-dioxygenase and tryptophan 2,3-dioxygenase by 3,8-substituted 5H-indeno[1,2-c]pyridazin-5-one derivatives | European journal of medicinal chemistry |
16292529 | 20060801 | Characterization of four Rhodococcus alcohol dehydrogenase genes responsible for the oxidation of aromatic alcohols | Applied microbiology and biotechnology |
Complexity: | 85 |
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: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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