4-Bromo-7-fluoroindole - CAS 883500-66-1

Catalog:	BB038827
Product Name:	4-Bromo-7-fluoroindole
CAS:	883500-66-1
Synonyms:	4-bromo-7-fluoro-1H-indole; 4-bromo-7-fluoro-1H-indole

Technical Data

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Computed Properties

IUPAC Name:	4-bromo-7-fluoro-1H-indole
Description:	4-Bromo-7-fluoroindole (CAS# 883500-66-1) is a useful research chemical.
Molecular Weight:	214.03
Molecular Formula:	C8H5BrFN
Canonical SMILES:	C1=CC(=C2C=CNC2=C1F)Br
InChI:	InChI=1S/C8H5BrFN/c9-6-1-2-7(10)8-5(6)3-4-11-8/h1-4,11H
InChI Key:	PBQKMEMSAFAVKF-UHFFFAOYSA-N
Boiling Point:	314.2 °C at 760 mmHg
Density:	1.75 g/cm³
Appearance:	Red to brown, low melting solid
MDL:	MFCD03095318
LogP:	3.06950

Publication Number	Title	Priority Date
TW-202002966-A	Prodrugs of fused-bicyclic C5aR antagonists	20180402
US-2019300526-A1	PRODRUGS OF FUSED-BICYCLIC C5aR ANTAGONISTS	20180402
CN-111954525-A	Prodrugs of fused bicyclic C5aR antagonists	20180402
KR-20200139751-A	Prodrugs of fused-bicyclic C5aR antagonists	20180402
BR-112020019822-A2	PROPHARMACEUTES OF C5AR Fused BICYCLIC ANTAGONISTS	20180402

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Related Functional Groups

Indoles

[53995-78-1]
Ethyl 5,6-dichloro-1H-indole-2-carboxylate
[1375064-43-9]
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[1375064-59-7]
Ethyl 3-Bromoindole-1-carboxylate
[467458-46-4]
Ethyl 3-formyl-1H-indole-5-carboxylate
[927181-98-4]
Ethyl 3-formyl-1H-indole-7-carboxylate
[879-37-8]
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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	212.95894
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	212.95894
Rotatable Bond Count:	0
Topological Polar Surface Area:	15.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8