4-Bromo-3-methylanisole - CAS 27060-75-9
Catalog: |
BB019451 |
Product Name: |
4-Bromo-3-methylanisole |
CAS: |
27060-75-9 |
Synonyms: |
1-bromo-4-methoxy-2-methylbenzene |
IUPAC Name: | 1-bromo-4-methoxy-2-methylbenzene |
Description: | 4-Bromo-3-methylanisole (CAS# 27060-75-9) is a useful research chemical. |
Molecular Weight: | 201.06 |
Molecular Formula: | C8H9BrO |
Canonical SMILES: | CC1=C(C=CC(=C1)OC)Br |
InChI: | InChI=1S/C8H9BrO/c1-6-5-7(10-2)3-4-8(6)9/h3-5H,1-2H3 |
InChI Key: | BLZNSXFQRKVFRP-UHFFFAOYSA-N |
Boiling Point: | 111-112 °C / 15 mmHg (lit.) |
Density: | 1.424 g/mL at 25°C(lit.) |
MDL: | MFCD00060687 |
LogP: | 2.76610 |
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-113004158-A | Preparation method and application of 2-methyl-4-methoxydiphenylamine | 20210304 |
CN-111892529-A | 6-chloro-5-hydroxyisoindole-1-one and synthesis method thereof | 20200819 |
WO-2021083310-A1 | Anti-cancer compounds acting as non-pgp substrate | 20191101 |
US-2020108083-A1 | Boron Containing PDE4 Inhibitors | 20181005 |
WO-2020070651-A1 | Boron containing pde4 inhibitors | 20181005 |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.98368 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.98368 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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