2-Heptanone
ALDRICH/W254430 - natural, 98%, FG
Synonym: Methyl pentyl ketone
CAS Number: 110-43-0
Empirical Formula (Hill Notation): C7H14O
Molecular Weight: 114.19
EC Number: 203-767-1
MDL Number: MFCD00009513
Linear Formula: CH3(CH2)4COCH3
Product Type: Chemical
agency | follows IFRA guidelines |
meets purity specifications of JECFA | |
application(s) | flavors and fragrances |
assay | 98% |
autoignition temp. | 739 °F |
bp | 149-150 °C (lit.) |
density | 0.82 g/mL at 25 °C (lit.) |
documentation | see Safety & Documentation for available documents |
expl. lim. | 1.11 %, 65 °F |
7.9 %, 121 °F | |
food allergen | no known allergens |
form | liquid |
fragrance allergen | no known allergens |
grade | FG |
Fragrance grade | |
Halal | |
Kosher | |
natural | |
InChI | 1S/C7H14O/c1-3-4-5-6-7(2) |
InChI key | CATSNJVOTSVZJV-UHFFFAOYSA |
mp | −35 °C (lit.) |
organoleptic | creamy; waxy; cheesy; fruity |
refractive index | n |
reg. compliance | EU Regulation 1223/2009 |
EU Regulation 1334/2008 & 178/2002 | |
FDA 21 CFR 117 | |
SMILES string | CCCCCC(C)=O |
vapor density | 3.94 (vs air) |
vapor pressure | 2.14 mmHg ( 20 °C) |
Packaging: | 1 kg in poly bottle |
Packaging: | 500 g in poly bottle |
Symbol | GHS02,GHS07 |
Signal word | Warning |
Hazard statements | H226 - H302 + H332 |
Hazard Codes | Xn |
Risk Statements | 10-20/22 |
Safety Statements | 24/25 |
RIDADR | UN1110 - class 3 - PG 3 - n-Amyl methyl ketone |
WGK Germany | WGK 1 |
Flash Point(F) | 105.8 °F - closed cup |
Flash Point(C) | 41 °C - closed cup |
Purity | 98% |
bp | 149-150 °C (lit.) |
mp | −35 °C (lit.) |
Density | 0.82 g/mL at 25 °C (lit.) |
Refractive Index | n |
FEMA Number | 2544 |
UNSPSC | 12164502 |