Dipyridin-3-ylmethanone - CAS 35779-35-2

Name: Dipyridin-3-ylmethanone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB022757
Product Name:	Dipyridin-3-ylmethanone
CAS:	35779-35-2
Synonyms:	dipyridin-3-ylmethanone

Technical Data

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Computed Properties

IUPAC Name:	dipyridin-3-ylmethanone
Description:	Dipyridin-3-ylmethanone (CAS# 35779-35-2) is a useful research chemical.
Molecular Weight:	184.19
Molecular Formula:	C11H8N2O
Canonical SMILES:	C1=CC(=CN=C1)C(=O)C2=CN=CC=C2
InChI:	InChI=1S/C11H8N2O/c14-11(9-3-1-5-12-7-9)10-4-2-6-13-8-10/h1-8H
InChI Key:	AQLPDLOXKZRZEV-UHFFFAOYSA-N
Boiling Point:	346.8 °C at 760 mmHg
Density:	1.196 g/cm³
LogP:	1.70760

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[4313-03-5]C7H10O
2,4-Heptadienal
[151585-93-2]C7H6FNO
2-Amino-6-fluorobenzaldehyde
[606-18-8]C7H6N2O4
2-Amino-3-nitrobenzoic Acid

Pyridines

[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[7356-60-7]C6H8ClN3
3-Amidinopyridine Hydrochloride
[76006-14-9]C6H4ClN3
3-Chloro-1H-pyrazolo[3,4-c]pyridine
[133928-61-7]C12H9ClN2O
4-Chloro-N-phenylpicolinamide
[19840-44-9]C6H3N2OBr
5-Bromo-1,6-dihydro-6-oxo-3-pyridinecarbonitrile
[2092299-60-8]C9H7ClN2
6-Chloro-3-cyclopropylpicolinonitrile

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P317, P330, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
EP-3294729-A1	Substituted quinoxaline derivatives	20150513
US-2018148429-A1	Substituted quinoxaline derivatives	20150513
WO-2016180536-A1	Substituted quinoxaline derivatives	20150513
EP-3218381-A1	Spiro-thiazolones	20141114
EP-3218381-B1	Spiro-thiazolones	20141114

PMID	Publication Date	Title	Journal
22719652	20120601	3,3'-Carbonyl-dipyridinium bis-(perchlorate)	Acta crystallographica. Section E, Structure reports online
22346873	20120201	Poly[[(μ(2)-di-3-pyridyl-methanone-κN:N')(μ(2)-hexa-fluoro-silicato-κF:F')copper(II)] dihydrate]	Acta crystallographica. Section E, Structure reports online
22259330	20120101	trans-Tetra-aqua-bis-[bis-(pyridin-3-yl)methanone-κN]manganese(II) bis-(perchlorate)	Acta crystallographica. Section E, Structure reports online
22199560	20111201	catena-Poly[(dichloridozinc)-μ-bis-(pyridin-3-yl)methanone-κN:N']	Acta crystallographica. Section E, Structure reports online
22199649	20111201	catena-Poly[[copper(II)-bis-[μ-bis-(pyridin-3-yl)methanone-κN:N']] bis-(tetra-fluorido-borate)]	Acta crystallographica. Section E, Structure reports online

Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.063662883
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.063662883
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8