2-Bromo-5-hydroxy-4-methoxybenzaldehyde - CAS 2973-59-3

Name: 2-Bromo-5-hydroxy-4-methoxybenzaldehyde
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB020295
Product Name:	2-Bromo-5-hydroxy-4-methoxybenzaldehyde
CAS:	2973-59-3
Synonyms:	2-bromo-5-hydroxy-4-methoxybenzaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromo-5-hydroxy-4-methoxybenzaldehyde
Description:	2-Bromo-5-hydroxy-4-methoxybenzaldehyde (CAS# 2973-59-3) is useful in DNA damage repair.
Molecular Weight:	231.04
Molecular Formula:	C8H7BrO3
Canonical SMILES:	COC1=C(C=C(C(=C1)Br)C=O)O
InChI:	InChI=1S/C8H7BrO3/c1-12-8-3-6(9)5(4-10)2-7(8)11/h2-4,11H,1H3
InChI Key:	AHYSXUDLJOFNAB-UHFFFAOYSA-N
Boiling Point:	320.8 °C at 760 mmHg
Purity:	97 %
Density:	1.653 g/cm³
MDL:	MFCD00195552
LogP:	1.97580

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[87-88-7]C6H2Cl2O4
Chloranilic acid
[17746-05-3]C11H21ClO
Undecanoyl chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

GHS Hazard Statement:	H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement:	P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, and P501
Signal Word:	Warning

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Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	229.95786
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	229.95786
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7