4-(Bromomethyl)benzaldehyde - CAS 51359-78-5

Catalog:	BB027417
Product Name:	4-(Bromomethyl)benzaldehyde
CAS:	51359-78-5
Synonyms:	4-(bromomethyl)benzaldehyde; 4-(bromomethyl)benzaldehyde

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Computed Properties

IUPAC Name:	4-(bromomethyl)benzaldehyde
Description:	4-(Bromomethyl)benzaldehyde (CAS# 51359-78-5) is a useful research chemical.
Molecular Weight:	199.04
Molecular Formula:	C8H7BrO
Canonical SMILES:	C1=CC(=CC=C1CBr)C=O
InChI:	InChI=1S/C8H7BrO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,6H,5H2
InChI Key:	XYPVBKDHERGKJG-UHFFFAOYSA-N
Boiling Point:	277.9 °C at 760 mmHg
Density:	1.524 g/cm³
MDL:	MFCD08271963
LogP:	2.39400

Publication Number	Title	Priority Date
CN-113331200-A	Weeding composition containing xaflufen-ethyl and flumetsulam	20210618
CN-112778533-A	Porphyrin-based porous organic polymer, preparation method thereof and synthesis method of cyclic carbonate	20210108
CN-111732567-A	Chromone framework-containing polycyclic compound, and preparation method and application thereof	20200617
WO-2021155050-A1	Kinase modulators, pharmaceutical compositions, and therapeutic applications	20200129
CN-111217776-A	Amide derivative containing benzo heterocyclic structure, composition and application	20200119

PMID	Publication Date	Title	Journal
22091137	20110801	{8-[4-(Bromo-meth-yl)benzo-yl]-2,7-dimeth-oxy-naphthalen-1-yl}[4-(bromo-meth-yl)phen-yl]methanone	Acta crystallographica. Section E, Structure reports online
11855704	20020202	Preparation and characterization of TADDOLs immobilized on hydrophobic controlled-pore-glass silica gel and their use in enantioselective heterogeneous catalysis	Chemistry (Weinheim an der Bergstrasse, Germany)

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Related Functional Groups

Carbonyl Compounds

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[55441-25-3]
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[832741-29-4]
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GHS Hazard Statement:	H302+H332 (33.33%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	106
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	197.96803
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	197.96803
Rotatable Bond Count:	2
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9