Ethyl 6-methyl-5-nitronicotinate - CAS 1211538-09-8

Catalog:	BB054626
Product Name:	Ethyl 6-methyl-5-nitronicotinate
CAS:	1211538-09-8
Synonyms:	Ethyl 6-methyl-5-nitro-pyridine-3-carboxylate

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	ethyl 6-methyl-5-nitropyridine-3-carboxylate
Molecular Weight:	210.19
Molecular Formula:	C9H10N2O4
Canonical SMILES:	CCOC(=O)C1=CC(=C(N=C1)C)[N+](=O)[O-]
InChI:	InChI=1S/C9H10N2O4/c1-3-15-9(12)7-4-8(11(13)14)6(2)10-5-7/h4-5H,3H2,1-2H3
InChI Key:	WQJCHEKAIFDWTN-UHFFFAOYSA-N
Boiling Point:	302.7±37.0 °C at 760 mmHg
Density:	1.272±0.06 g/cm3

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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
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

Oxygen Compounds

[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[5416-55-7]
2,2,6,6-Tetrakis(hydroxymethyl)cyclohexanol
[832740-55-3]
3-[(4-Chloro-2-methylphenoxy)methyl]-4-methoxybenzaldehyde
[438218-12-3]
5-[(2-Methoxyphenoxy)methyl]furan-2-carbaldehyde
[832740-87-1]
5-[(3-Chloro-2-methylphenoxy)methyl]furan-2-carbaldehyde

Pyridines

[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[1951441-75-0]
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride
[76167-49-2]
2-(Pyridin-3-yloxy)aniline
[942206-23-7]
2,5-Dichloro-3-iodopyridine
[4926-28-7]
2-Bromo-4-methylpyridine

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	251
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.0640568
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	210.0640568
Rotatable Bond Count:	3
Topological Polar Surface Area:	85
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3