200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89149-21-3
89149-21-3 | 2-Propenal, 2-methyl-3-(2,4,6-trimethyl-3-cyclohexen-1-yl)-
CAS No: 89149-21-3 Catalog No: AG003WTC MDL No:
Product Description
Catalog Number:
AG003WTC
Chemical Name:
2-Propenal, 2-methyl-3-(2,4,6-trimethyl-3-cyclohexen-1-yl)-
CAS Number:
89149-21-3
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
IUPAC Name:
2-methyl-3-(2,4,6-trimethylcyclohex-3-en-1-yl)prop-2-enal
InChI:
InChI=1S/C13H20O/c1-9-5-11(3)13(12(4)6-9)7-10(2)8-14/h5,7-8,11-13H,6H2,1-4H3
InChI Key:
XMXAEABATCTYAM-UHFFFAOYSA-N
SMILES:
O=CC(=CC1C(C)CC(=CC1C)C)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.151g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.302g/mol
Monoisotopic Mass:
192.151g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.