200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 122711-85-7
122711-85-7 | 3,4-Heptadien-2-one
CAS No: 122711-85-7 Catalog No: AG000J0V MDL No:
Product Description
Catalog Number:
AG000J0V
Chemical Name:
3,4-Heptadien-2-one
CAS Number:
122711-85-7
Molecular Formula:
C7H10O
Molecular Weight:
110.1537
IUPAC Name:
hepta-3,4-dien-2-one
InChI:
InChI=1S/C7H10O/c1-3-4-5-6-7(2)8/h4,6H,3H2,1-2H3
InChI Key:
RJRCMWRNGRFTCC-UHFFFAOYSA-N
SMILES:
CCC=C=CC(=O)C
Properties
Complexity:
127
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.156g/mol
Monoisotopic Mass:
110.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.