4-Bromo-3-methylanisole - CAS 27060-75-9

Name: 4-Bromo-3-methylanisole
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB019451
Product Name:	4-Bromo-3-methylanisole
CAS:	27060-75-9
Synonyms:	1-bromo-4-methoxy-2-methylbenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

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

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Related Functional Groups

Halides

[859473-05-5]C9H6Cl2N2S
N-(3,4-Dichlorophenyl)-1,3-thiazol-2-amine
[111-85-3]C8H17Cl
1-Chlorooctane
[199114-62-0]C10H9ClN2O
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[1431970-24-9]C8H14ClF2N3
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride
[73084-03-4]C11H18ClN3
2,4-di-tert-butyl-6-chloro-1,3,5-triazine
[2114-39-8]C9H11Br
2-Bromo-1-phenylpropane

Oxygen Compounds

[134769-80-5]C11H16O2
3-Methylphenylacetaldehyde dimethyl acetal
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[56517-33-0]C11H13BrO3
2-Bromo-4-isopropoxy-5-methoxybenzaldehyde
[88-60-8]C11H16O
2-tert-Butyl-5-methylphenol
[5724-76-5]C7H9NO4
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid

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