Methyl nicotinate: Difference between revisions

Revision as of 02:42, 24 December 2024 editLeiem (talk \| contribs)Extended confirmed users, IP block exemptions2,299 edits removed Category:Nicotinates; added Category:Nicotinate esters using HotCat ← Previous edit		Revision as of 01:48, 26 December 2024 edit undoGraeme Bartlett (talk \| contribs)Administrators249,716 edits more ids and hazards from pubchemNext edit →
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	<!-- Sections -->		<!-- Sections -->
	\| Section1 = {{Chembox Identifiers		\| Section1 = {{Chembox Identifiers
	\| CASNo = 93-60-7		\| CASNo = 93-60-7
			\| ChEBI = 134761
			\| ChEMBL = 379845
			\| ChemSpiderID = 21111785
		⚫	\| DrugBank = DB13882
			\| EC_number = 202-261-8
			\| KEGG = D04991
	\| PubChem = 7151		\| PubChem = 7151
	\| UNII = 7B1AVU9DJN		\| UNII = 7B1AVU9DJN
			\| StdInChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3
⚫	\| DrugBank = DB13882
			\| StdInChIKey = YNBADRVTZLEFNH-UHFFFAOYSA-N
	\| SMILES = COC(=O)C1=CN=CC=C1		\| SMILES = COC(=O)C1=CN=CC=C1
	}}		}}
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	}}		}}
	\| Section3 = {{Chembox Hazards		\| Section3 = {{Chembox Hazards
			\| GHS_ref=
			\| GHSPictograms = {{GHS07}}
			\| GHSSignalWord = Warning
			\| HPhrases = {{H-phrases\|315\|319}}
			\| PPhrases = {{P-phrases\|264\|264+265\|280\|302+352\|305+351+338\|321\|332+317\|337+317\|362+364}}
	\| MainHazards =		\| MainHazards =
	\| FlashPt =		\| FlashPt =

Revision as of 01:48, 26 December 2024

Not to be confused with Menthyl nicotinate.

Methyl nicotinate
Names

IUPAC name Methyl pyridine-3-carboxylate
Other names Nicotinic acid methyl ester; Nikomet
Identifiers
CAS Number	93-60-7
3D model (JSmol)	Interactive image
ChEBI	CHEBI:134761
ChEMBL	ChEMBL379845
ChemSpider	21111785
DrugBank	DB13882
ECHA InfoCard	100.002.057
EC Number	202-261-8
KEGG	D04991
PubChem CID	7151
UNII	7B1AVU9DJN
CompTox Dashboard (EPA)	DTXSID7044471
InChI InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3Key: YNBADRVTZLEFNH-UHFFFAOYSA-N
SMILES COC(=O)C1=CN=CC=C1
Properties
Chemical formula	C₇H₇NO₂
Molar mass	137.138 g·mol
Melting point	39 °C (102 °F; 312 K)
Boiling point	209 °C (408 °F; 482 K)
Hazards
GHS labelling:
Pictograms
Signal word	Warning
Hazard statements	H315, H319
Precautionary statements	P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). Infobox references