200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 823228-12-2
823228-12-2 | Benzaldehyde, 3-(3-decene-1,5-diynyl)-
CAS No: 823228-12-2 Catalog No: AG005E1F MDL No:
Product Description
Catalog Number:
AG005E1F
Chemical Name:
Benzaldehyde, 3-(3-decene-1,5-diynyl)-
CAS Number:
823228-12-2
Molecular Formula:
C17H16O
Molecular Weight:
236.3083
IUPAC Name:
3-dec-3-en-1,5-diynylbenzaldehyde
InChI:
InChI=1S/C17H16O/c1-2-3-4-5-6-7-8-9-11-16-12-10-13-17(14-16)15-18/h7-8,10,12-15H,2-4H2,1H3
InChI Key:
QSSYUBADMAYZHF-UHFFFAOYSA-N
SMILES:
CCCCC#CC=CC#Cc1cccc(c1)C=O
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.314g/mol
Monoisotopic Mass:
236.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.