4-Bromo-3-(trifluoromethyl)benzaldehyde - CAS 34328-47-7

Catalog:	BB022073
Product Name:	4-Bromo-3-(trifluoromethyl)benzaldehyde
CAS:	34328-47-7
Synonyms:	4-bromo-3-(trifluoromethyl)benzaldehyde; 4-bromo-3-(trifluoromethyl)benzaldehyde

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-bromo-3-(trifluoromethyl)benzaldehyde
Description:	4-Bromo-3-(trifluoromethyl)benzaldehyde (CAS# 34328-47-7) is a useful research chemical.
Molecular Weight:	253.02
Molecular Formula:	C8H4BrF3O
Canonical SMILES:	C1=CC(=C(C=C1C=O)C(F)(F)F)Br
InChI:	InChI=1S/C8H4BrF3O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-4H
InChI Key:	JPNOSHZBKVMMSB-UHFFFAOYSA-N
Boiling Point:	236.5 °C at 760 mmHg
Density:	1.677 g/cm³
MDL:	MFCD08059130
LogP:	3.28040

Publication Number	Title	Priority Date
CN-109956898-A	Immunomodulator and its preparation method and purposes pharmaceutically	20171222
WO-2019120297-A1	Immunomodulator and preparation method and medical use thereof	20171222
CN-109956898-B	Immunomodulator, preparation method and medical application thereof	20171222
AU-2018271876-A1	Pyrazole MAGL inhibitors	20170523
AU-2018273888-A1	Pyrazole MAGL inhibitors	20170523

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1427004-19-0]
DBCO-PEG4-NHS ester
[832741-29-4]
1-(4-Bromo-5-propylthiophen-2-yl)ethanone
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

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

Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	251.93976
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	251.93976
Rotatable Bond Count:	1
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3