3,5-Dimethyl-3-cyclohexenone - CAS 63507-69-7
Catalog: |
BB032175 |
Product Name: |
3,5-Dimethyl-3-cyclohexenone |
CAS: |
63507-69-7 |
Synonyms: |
3,5-dimethyl-1-cyclohex-3-enone; 3,5-dimethylcyclohex-3-en-1-one |
IUPAC Name: | 3,5-dimethylcyclohex-3-en-1-one |
Description: | 3,5-Dimethyl-3-cyclohexenone (CAS# 63507-69-7 ) is a useful research chemical. |
Molecular Weight: | 124.18 |
Molecular Formula: | C8H12O |
Canonical SMILES: | CC1CC(=O)CC(=C1)C |
InChI: | InChI=1S/C8H12O/c1-6-3-7(2)5-8(9)4-6/h3,6H,4-5H2,1-2H3 |
InChI Key: | CPNYQHOMBQQSSI-UHFFFAOYSA-N |
LogP: | 1.93170 |
Publication Number | Title | Priority Date |
CA-1222638-A | Method for combatting blackgrass in cereal crops and compositions therefor | 19820707 |
EP-0100156-A2 | A method for combatting blackgrass in cereal crops and compositions therefor | 19820707 |
EP-0253374-A1 | A method for combatting blackgrass in cereal crops and compositions therefor | 19820707 |
US-4640705-A | Method for combatting blackgrass in cereal crops and compositions therefor | 19820707 |
EP-0051803-B1 | Process for the preparation of 3,5-dimethyl aniline (sym. m-xylidine) | 19801106 |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.088815002 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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