1-(3-Methylpyridin-2-Yl)Acetone

AKOS P-2123583 · 1-(3-Methylpyridin-2-yl)acetone · 1-(3-Methylpyridin-2-yl)propan-2-one · 1-(3-Methyl-2-pyridinyl)-2-propanone · 2-Propanone, 1-(3-methyl-2-pyridinyl)- · 1-(3-methylpyridin-2-yl)acetone(SALTDATA: FREE)

https://huagongshe.com/en/chemical/16640571

1-(3-Methylpyridin-2-Yl)Acetone molecular structure

Identifiers & Physical Properties

CAS No.	39050-03-8
Molecular formula	C9H11NO
Average molar mass	149.19 g/mol
Monoisotopic mass	149.08406397 g/mol
SMILES	CC(=O)Cc1ncccc1C
InChIKey	GBHJULOPIKRXAE-UHFFFAOYSA-N
PubChem CID	16640571
ChEMBL	CHEMBL3229452
EC No.	106-928-3
DTXSID	DTXSID80586312

Chemical & Physical Properties

XLogP	0.9
Topological polar surface area	30
Hydrogen bond donors	0
Hydrogen bond acceptors	2
Rotatable bonds	2
Heavy atoms	11
Formal charge	0
Complexity	144
Physical state	solid
InChI	1S/C9H11NO/c1-7-4-3-5-10-9(7)6-8(2)11/h3-5H,6H2,1-2H3
InChIKey	GBHJULOPIKRXAE-UHFFFAOYSA-N
SMILES	O=C(C)CC(N=CC=C1)=C1C
UNSPSC Code	12352200
GHS pictogram	GHS07
Signal word	Warning
GHS hazard statements	H302
GHS precautionary statements	P280-P305+P351+P338
Hazard symbols	Xn
Risk statements (R)	22
Water hazard class (WGK)	3
Storage class	11 - Combustible Solids
Hazard class	Acute Tox. 4 Oral

Safety & Regulations

GHS classification	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Acute Tox. 4 (100%)
Water hazard class (WGK)	3
Risk statements (R)	22
Signal word	Warning
GHS pictogram	GHS07
Hazard symbols	Xn
Storage class	11 - Combustible Solids
GHS hazard statements	H302
Hazard class	Acute Tox. 4 Oral
GHS precautionary statements	P280-P305+P351+P338