7-Bromoindole-3-acetic Acid - CAS 63352-97-6

Name: 7-Bromoindole-3-acetic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB032113
Product Name:	7-Bromoindole-3-acetic Acid
CAS:	63352-97-6
Synonyms:	2-(7-bromo-1H-indol-3-yl)acetic acid; 2-(7-bromo-1H-indol-3-yl)acetic acid

Technical Data

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Computed Properties

IUPAC Name:	2-(7-bromo-1H-indol-3-yl)acetic acid
Description:	7-Bromoindole-3-acetic Acid (CAS# 63352-97-6) is a useful research chemical compound.
Molecular Weight:	254.08
Molecular Formula:	C10H8BrNO2
Canonical SMILES:	C1=CC2=C(C(=C1)Br)NC=C2CC(=O)O
InChI:	InChI=1S/C10H8BrNO2/c11-8-3-1-2-7-6(4-9(13)14)5-12-10(7)8/h1-3,5,12H,4H2,(H,13,14)
InChI Key:	XYQBUBGQOKPXBN-UHFFFAOYSA-N
LogP:	2.55750

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Related Functional Groups

Carbonyl Compounds

[87-88-7]C6H2Cl2O4
Chloranilic acid
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[17746-05-3]C11H21ClO
Undecanoyl chloride
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[59855-96-8]C6H7NO3S
2-(Methoxymethyl)thiazole-5-carboxylic Acid
[1016519-61-1]C8H10N2O2
2-(Methyl-2-pyridylamino)acetic Acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-103621505-A	Application of halogenated indole-3-acetic acid as herbicide	20131118
US-2008196124-A1	Plant Growth Hormone Regulated Transcription Factors and Promoters Thereof	20060427
WO-2007127923-A2	Plant growth hormone regulated transcription factors and promoters thereof	20060427
DE-60101914-T2	USE OF INDOL-3-ACETIC ACID DERIVATIVES IN THERAPY	20000630
EP-1296676-A1	Use of indole-3-acetic acid derivatives in medicine	20000630

Complexity:	234
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	252.97384
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	252.97384
Rotatable Bond Count:	2
Topological Polar Surface Area:	53.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2