2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-


Chemical Name: 2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-
CAS Number: 43052-87-5
Product Number: AG00DEKV(AGN-PC-0JL4SK)
Synonyms:
MDL No:
Molecular Formula: C13H20O
Molecular Weight: 192.2973

Identification/Properties


Properties
BP:
267.1 °C at 760 mmHg
Storage:
2-8℃;Inert atmosphere;Light sensitive;
Computed Properties
Molecular Weight:
192.302g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
192.151g/mol
Monoisotopic Mass:
192.151g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
282
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback