3,6-Dichloropyridine-2-carbonitrile - CAS 1702-18-7

Catalog:	BB012624
Product Name:	3,6-Dichloropyridine-2-carbonitrile
CAS:	1702-18-7
Synonyms:	3,6-dichloro-2-pyridinecarbonitrile; 3,6-dichloropyridine-2-carbonitrile

Technical Data

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Computed Properties

IUPAC Name:	3,6-dichloropyridine-2-carbonitrile
Description:	3,6-Dichloropyridine-2-carbonitrile (CAS# 1702-18-7) is a useful research chemical.
Molecular Weight:	173.00
Molecular Formula:	C6H2Cl2N2
Canonical SMILES:	C1=CC(=NC(=C1Cl)C#N)Cl
InChI:	InChI=1S/C6H2Cl2N2/c7-4-1-2-6(8)10-5(4)3-9/h1-2H
InChI Key:	AFSVHZPQZBOZDK-UHFFFAOYSA-N
MDL:	MFCD00546824
LogP:	2.26008

Publication Number	Title	Priority Date
US-2018037594-A1	Oxadiazolopyridine Derivates for Use as Ghrelin O-Acyl Transferase (GOAT) Inhibitors	20160805
US-9994591-B2	Oxadiazolopyridine derivates for use as ghrelin O-acyl transferase (GOAT) inhibitors	20160805
CN-106243027-A	A kind of preparation method of 3,6 dichloro 2 picolinic acids	20160728
CN-106243027-B	A kind of preparation method of 3,6- dichloro-2-pyridyl carboxylic acid	20160728
US-10617675-B2	Hepatitis C virus inhibitors	20150806

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Related Functional Groups

Nitrogen Compounds

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.9595035
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	171.9595035
Rotatable Bond Count:	0
Topological Polar Surface Area:	36.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9