200,000+ products from a single source!
sales@angenechem.com
86778-46-3 | 1,3-Cyclohexadiene-1-carboxaldehyde, 4,6-dimethyl-
CAS No: 86778-46-3 Catalog No: AG008F0G MDL No:
Product Description
Catalog Number:
AG008F0G
Chemical Name:
1,3-Cyclohexadiene-1-carboxaldehyde, 4,6-dimethyl-
CAS Number:
86778-46-3
Molecular Formula:
C9H12O
Molecular Weight:
136.1910
IUPAC Name:
4,6-dimethylcyclohexa-1,3-diene-1-carbaldehyde
InChI:
InChI=1S/C9H12O/c1-7-3-4-9(6-10)8(2)5-7/h3-4,6,8H,5H2,1-2H3
InChI Key:
RWPGGEQITQMYBH-UHFFFAOYSA-N
SMILES:
CC1CC(=CC=C1C=O)C
Properties
Complexity:
199
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.089g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.194g/mol
Monoisotopic Mass:
136.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.