4-Bromo-2-methoxybenzyl alcohol - CAS 17102-63-5

Name: 4-Bromo-2-methoxybenzyl alcohol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB012700
Product Name:	4-Bromo-2-methoxybenzyl alcohol
CAS:	17102-63-5
Synonyms:	(4-bromo-2-methoxyphenyl)methanol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(4-bromo-2-methoxyphenyl)methanol
Description:	4-Bromo-2-methoxybenzyl alcohol (CAS# 17102-63-5) is a useful research chemical.
Molecular Weight:	217.06
Molecular Formula:	C8H9BrO2
Canonical SMILES:	COC1=C(C=CC(=C1)Br)CO
InChI:	InChI=1S/C8H9BrO2/c1-11-8-4-7(9)3-2-6(8)5-10/h2-4,10H,5H2,1H3
InChI Key:	HBEIHPSICGGZIF-UHFFFAOYSA-N
Boiling Point:	290.6 °C at 760 mmHg
Melting Point:	66-70 °C (lit.)
Purity:	95 %
Density:	1.513 g/cm³
MDL:	MFCD07369762
LogP:	1.95000

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Related Functional Groups

Oxygen Compounds

[134769-80-5]C11H16O2
3-Methylphenylacetaldehyde dimethyl acetal
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[832740-55-3]C16H15ClO3
3-[(4-Chloro-2-methylphenoxy)methyl]-4-methoxybenzaldehyde
[13566-71-7]C10H8N2O2
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[1328640-88-5]C7H9F2N3O3
5-((2,2-Difluoroethoxy)methyl)-1-methyl-3-nitro-1H-pyrazole

GHS Hazard Statement:	H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021154666-A1	1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS	20200127
WO-2021154669-A1	1H-PYRAZOLO[4,3-d]PYRIMIDINE COMPOUNDS AS TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS	20200127
WO-2020011209-A1	Immunosuppressive agent, preparation method therefor and pharmaceutical use thereof	20180711
CN-111886219-A	Immunosuppressant, preparation method and pharmaceutical application thereof	20180711
TW-202019869-A	Immunosuppressant and its preparation method and application in pharmacy	20180711

Complexity:	119
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	215.97859
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	215.97859
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7