Isophorone

ALDRICH/I18709 - 97%

Synonym: 3,5,5-Trimethyl-2-cyclohexen-1-one

CAS Number: 78-59-1
Empirical Formula (Hill Notation): C₉H₁₄O
Molecular Weight: 138.21
EC Number: 201-126-0
MDL Number: MFCD00001584
Linear Formula: C₉H₁₄O
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-I18709-5ML	5 mL	$24.20 1/EA		Add To Favorites
45-I18709-100ML	100 mL	$32.00 1/EA		Add To Favorites
45-I18709-1L	1 L	$65.50 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	97%
autoignition temp.	864 °F
bp	213-214 °C (lit.)
density	0.923 g/mL at 25 °C (lit.)
expl. lim.	3.8 %
form	liquid
InChI	1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChI key	HJOVHMDZYOCNQW-UHFFFAOYSA-N
mp	−8 °C (lit.)
refractive index	n20/D 1.476 (lit.)
SMILES string	CC1=CC(=O)CC(C)(C)C1
vapor density	4.77 (vs air)
vapor pressure	0.2 mmHg ( 20 °C)

Packaging:	1 L in glass bottle
Packaging:	5, 100 mL in glass bottle

Symbol	GHS07,GHS08
Signal word	Warning
Hazard statements	H302 + H312 - H319 - H335 - H351
Precautionary statements	P201 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338 - P308 + P313
Hazard Codes	Xn
Risk Statements	21/22-36/37-40
Safety Statements	13-23-36/37/39-46
RIDADR	UN 3082 9 / PGIII
WGK Germany	WGK 1
Flash Point(F)	204.8 °F - closed cup
Flash Point(C)	96.0 °C - closed cup

Purity	97%
bp	213-214 °C (lit.)
mp	−8 °C (lit.)
Density	0.923 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.476 (lit.)
UNSPSC	12352100

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