2-Bromo-3,5-dimethoxytoluene - CAS 13321-73-8

Name: 2-Bromo-3,5-dimethoxytoluene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB007706
Product Name:	2-Bromo-3,5-dimethoxytoluene
CAS:	13321-73-8
Synonyms:	2-bromo-1,5-dimethoxy-3-methylbenzene

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Computed Properties

IUPAC Name:	2-bromo-1,5-dimethoxy-3-methylbenzene
Description:	2-Bromo-3,5-dimethoxytoluene (CAS# 13321-73-8 ) is a useful research chemical.
Molecular Weight:	231.09
Molecular Formula:	C9H11BrO2
Canonical SMILES:	CC1=CC(=CC(=C1Br)OC)OC
InChI:	InChI=1S/C9H11BrO2/c1-6-4-7(11-2)5-8(12-3)9(6)10/h4-5H,1-3H3
InChI Key:	RONRLLIJBQHXCI-UHFFFAOYSA-N
Boiling Point:	283.4 °C at 760 mmHg
Melting Point:	50-54 °C
Purity:	95 %
Density:	1.36 g/cm³
MDL:	MFCD09265106
LogP:	2.77470

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Related Functional Groups

Oxygen Compounds

[52378-69-5]C13H19O3P
Diethyl trans-cinnamylphosphonate
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[5416-55-7]C10H20O5
2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol
[37503-42-7]C10H14O3
2-Hydroxyethyl bicyclo[2.2.1]hept-5-ene-2-carboxylate

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GHS Hazard Statement:	H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement:	P264, P280, P305+P351+P338, and P337+P313
Signal Word:	Warning

Publication Number	Title	Priority Date
US-2017260168-A1	2-aryl- and 2-heteroaryl-substituted 2-pyridazin-3(2h)-one compounds as inhibitors of fgfr tyrosine kinases	20151023
WO-2017070708-A1	2-aryl- and 2-heteroaryl-substituted 2-pyridazin-3(2h)-one compounds as inhibitors of fgfr tyrosine kinases	20151023
US-2016207034-A1	Phosphorus-containing catalysts	20130829
US-2017282170-A9	Phosphorus-containing catalysts	20130829
US-2014256830-A1	Resorcinol compounds for dermatological use	20130308

Complexity:	141
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.99424
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	229.99424
Rotatable Bond Count:	2
Topological Polar Surface Area:	18.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9