3,5-Heptanedione

ALDRICH/280070 - 97%

CAS Number: 7424-54-6
Empirical Formula (Hill Notation): C₇H₁₂O₂
Molecular Weight: 128.17
EC Number: 231-054-5
MDL Number: MFCD00015186
Linear Formula: H₃CCH₂COCH₂COCH₂CH₃
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-280070-5G-A	5 g	$103.00 1/EA		Add To Favorites
45-280070-25G-A	25 g	$252.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	97%
bp	175-177 °C/754 mmHg (lit.)
density	0.946 g/mL at 25 °C (lit.)
functional group	ketone
InChI	1S/C7H12O2/c1-3-6(8)5-7(9)4-2/h3-5H2,1-2H3
InChI key	DGCTVLNZTFDPDJ-UHFFFAOYSA-N
Quality Level	100
refractive index	n20/D 1.456 (lit.)
SMILES string	CCC(=O)CC(=O)CC

Application:	3,5-Heptanedione has been used in: • preparation of 3,5-diethylpyrazole hydrochloride • enantioselective conjugate addition of 1,3-dicarbonyls to nitroolefins via nickel(II)-diamine catalysis
Packaging:	5, 25 g in glass bottle

Symbol	GHS02
Signal word	Warning
Hazard statements	H226
RIDADR	UN1224 - class 3 - PG 3 - Ketones, liquid, n.o.s., HI: all
WGK Germany	WGK 3
Flash Point(F)	135.0 °F - closed cup
Flash Point(C)	57.2 °C - closed cup

Purity	97%
bp	175-177 °C/754 mmHg (lit.)
Density	0.946 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.456 (lit.)
UNSPSC	12352100

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