3-Bromo-4-chlorobenzyl Alcohol - CAS 329218-12-4
Catalog: |
BB021484 |
Product Name: |
3-Bromo-4-chlorobenzyl Alcohol |
CAS: |
329218-12-4 |
Synonyms: |
(3-bromo-4-chlorophenyl)methanol; (3-bromo-4-chlorophenyl)methanol |
IUPAC Name: | (3-bromo-4-chlorophenyl)methanol |
Description: | 3-Bromo-4-chlorobenzyl Alcohol (CAS# 329218-12-4) is a useful research chemical. |
Molecular Weight: | 221.48 |
Molecular Formula: | C7H6BrClO |
Canonical SMILES: | C1=CC(=C(C=C1CO)Br)Cl |
InChI: | InChI=1S/C7H6BrClO/c8-6-3-5(4-10)1-2-7(6)9/h1-3,10H,4H2 |
InChI Key: | ZUXLQZNUPRSYEX-UHFFFAOYSA-N |
LogP: | 2.59480 |
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 |
AU-2014214254-A1 | Macrocyclic Pyridazinone derivatives | 20130207 |
AU-2014214254-B2 | Macrocyclic Pyridazinone derivatives | 20130207 |
DK-2953952-T3 | MACROCYCLIC PYRIDAZININE DERIVATIVES | 20130207 |
EP-2953952-A1 | Macrocyclic pyridazinone derivatives | 20130207 |
EP-2953952-B1 | Macrocyclic pyridazinone derivatives | 20130207 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.92906 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.92906 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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