200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 84004-86-4
84004-86-4 | 5-Hexen-2-ynal
CAS No: 84004-86-4 Catalog No: AG004QH4 MDL No:
Product Description
Catalog Number:
AG004QH4
Chemical Name:
5-Hexen-2-ynal
CAS Number:
84004-86-4
Molecular Formula:
C6H6O
Molecular Weight:
94.1112
IUPAC Name:
hex-5-en-2-ynal
InChI:
InChI=1S/C6H6O/c1-2-3-4-5-6-7/h2,6H,1,3H2
InChI Key:
CRQBSSGCRLPREB-UHFFFAOYSA-N
SMILES:
C=CCC#CC=O
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.042g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.113g/mol
Monoisotopic Mass:
94.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.