(1R-trans)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride
PubChem CID: 26620
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| Compound Synonyms | Chrysanthemoyl chloride, 14297-81-5, EINECS 224-780-9, Cyclopropanecarbonylchloride, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbonyl chloride, (1R-trans)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride, 4489-14-9, Chrysanthemic acid chloride, 53955-46-7, Chrysanthemumoyl chloride, Chrysanthemumic acid chloride, Chrysanthemummonocarbonyl chloride, (1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride, EINECS 238-229-5, Chrysanthemoylchloride, Chrysanthemoyl-chlorid, Cyclopropanecarbonyl chloride, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, CYCLOPROPANECARBONYL CHLORIDE, 2,2-DIMETHYL-3-(2-METHYLPROPENYL)-, SCHEMBL554915, DTXSID50931698, EINECS 258-886-1, AKOS006277116, 2,2-DIMETHYL-3-(2-METHYLPROP-1-EN-1-YL)CYCLOPROPANE-1-CARBONYL CHLORIDE, NS00087519, 2,2-dimethyl-3-(1-isobutenyl)-cyclopropanecarboxylic acid chloride, 2,2-Dimethyl-3-(2-methyl-1-propenyl)-cyclopropanecarbonylchloride, 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarbonyl chloride, 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride, 2,2-dimethyl-3-isobutenylcyclopropane-1-carboxylic acid chloride, 3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarboxylic chloride, 3-(2-methyl-1-propenyl)-2,2-dimethylcyclo-propanecarboxylic acid chloride, 3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarboxylic acid chloride, 224-780-9 |
|---|---|
| Topological Polar Surface Area | 17.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 236.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbonyl chloride |
| Prediction Hob | 1.0 |
| Xlogp | 4.4 |
| Molecular Formula | C10H15ClO |
| Prediction Swissadme | 0.0 |
| Inchi Key | VNTCVNLNEOVBEE-UHFFFAOYSA-N |
| Fcsp3 | 0.7 |
| Logs | -4.545 |
| Rotatable Bond Count | 2.0 |
| Logd | 3.837 |
| Compound Name | (1R-trans)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 186.081 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 186.081 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 186.68 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.6500283999999996 |
| Inchi | InChI=1S/C10H15ClO/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3 |
| Smiles | CC(=CC1C(C1(C)C)C(=O)Cl)C |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Chrysanthemum Indicum (Plant) Rel Props:Source_db:cmaup_ingredients