2-bromo-1H-indole-3-carbaldehyde - CAS 119910-45-1

Catalog:	BB054729
Product Name:	2-bromo-1H-indole-3-carbaldehyde
CAS:	119910-45-1
Synonyms:	1H-Indole-3-carboxaldehyde, 2-bromo-; 2-bromo-1h-indole-3-carboxaldehyde

Technical Data

Computed Properties

IUPAC Name:	2-bromo-1H-indole-3-carbaldehyde
Molecular Weight:	224.05
Molecular Formula:	C9H6BrNO
Canonical SMILES:	C1=CC=C2C(=C1)C(=C(N2)Br)C=O
InChI:	InChI=1S/C9H6BrNO/c10-9-7(5-12)6-3-1-2-4-8(6)11-9/h1-5,11H
InChI Key:	WIRLVLFYTTULCM-UHFFFAOYSA-N

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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
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[927676-51-5]
2-(6-Bromo-3-indolyl)-2-oxoacetic Acid

Halides

[134005-20-2]
(Z)-1,3-Diiodo-2-butene
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[199114-62-0]
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[1936054-65-7]
2,4-Dichloro-3,6-dimethylquinoline
[73084-03-4]
2,4-di-tert-butyl-6-chloro-1,3,5-triazine

Indoles

[109021-59-2]
7-Methoxy-1H-indole-3-carbaldehyde
[53995-78-1]
Ethyl 5,6-dichloro-1H-indole-2-carboxylate
[1375064-43-9]
Ethyl 3-Bromo-7-methylindole-1-carboxylate
[84639-06-5]
Ethyl 7-(benzyloxy)-1H-indole-2-carboxylate
[20538-12-9]
Ethyl 7-methoxy-1H-indole-2-carboxylate
[771-50-6]
Indole-3-carboxylic acid

Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	222.96328
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	222.96328
Rotatable Bond Count:	1
Topological Polar Surface Area:	32.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5