3-(Bromoacetyl)pyridine hydrobromide - CAS 17694-68-7

Name: 3-(Bromoacetyl)pyridine hydrobromide
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB013259
Product Name:	3-(Bromoacetyl)pyridine hydrobromide
CAS:	17694-68-7
Synonyms:	2-bromo-1-pyridin-3-ylethanone;hydrobromide

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromo-1-pyridin-3-ylethanone;hydrobromide
Description:	A useful synthetic intermediate.
Molecular Weight:	280.94
Molecular Formula:	C7H7Br2NO
Canonical SMILES:	C1=CC(=CN=C1)C(=O)CBr.Br
InChI:	InChI=1S/C7H6BrNO.BrH/c8-4-7(10)6-2-1-3-9-5-6;/h1-3,5H,4H2;1H
InChI Key:	WDTSYONULAZKIE-UHFFFAOYSA-N
Boiling Point:	275.9 °C at 760 mmHg
Melting Point:	192 °C
Purity:	95 %
Appearance:	White crystalline solid
MDL:	MFCD00052182
LogP:	2.61730

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[2168559-63-3]C8H10ClNO2
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride

Pyridines

[202288-73-1]C12H14Cl2N2O
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[63585-69-3]C6H7ClN2O2
2-Methyl-3-nitropyridine Hydrochloride
[1198098-45-1]C11H12N2
3-Allyl-5-methyl-1H-pyrrolo[2,3-b]pyridine
[1087659-19-5]C14H12N2O4
3-Methoxy-5-(phenylcarbamoyl)isonicotinic acid
[2241983-13-9]C24H26NOD
5-[(8S,9S,13S,14S)-3-Methoxy-13-methyl-7,8,9,11,12,13,14,15-octahydro-6H-cyclopenta[a]phenanthren-17-yl]pyridine-2-D
[19840-44-9]C6H3N2OBr
5-Bromo-1,6-dihydro-6-oxo-3-pyridinecarbonitrile

GHS Hazard Statement:	H302 (86.96%): 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

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US-2021230153-A1	Aryl hydrocarbon receptor (ahr) agonists and uses thereof	20191220
WO-2021127301-A1	4-phenyl-n-(phenyl)thiazol-2-amine derivatives and related compounds as aryl hydrocarbon receptor (ahr) agonists for the treatment of e.g. angiogenesis implicated or inflammatory disorders	20191220
WO-2021116178-A1	Pyrazolotriazines	20191211
WO-2021055612-A1	Substituted imidazole carboxamides and their use in the treatment of medical disorders	20190917
KR-20210021830-A	Novel compound with cancer metastasis inhibiting activity, method for preparing the same and pharmaceutical composition for inhibiting cancer metastasis and invasion or treating colon cancer	20190819

Complexity:	127
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	280.88739
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	278.88944
Rotatable Bond Count:	2
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0