Allyl cyclohexanepropionate
Properties
- Molecular formula
- C12H20O2
- Molar mass
- 196.29 g/mol
- Exact mass
- 196.1463 Da
- Density
- 0.945–0.95 g/mL
- logP
- 3.08Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 5
Hazards
Warning
- H302 Harmful if swallowed99.9% of notifiers
- H312 Harmful in contact with skin98% of notifiers
- H315 Causes skin irritation13% of notifiers
- H317 May cause an allergic skin reaction83% of notifiers
- H332 Harmful if inhaled84% of notifiers
- H400 Very toxic to aquatic life81.9% of notifiers
- H410 Very toxic to aquatic life with long lasting effects83.2% of notifiers
Aggregated from 2,014 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P332+P317, P333+P317, P362+P364, P391, P501
Identifiers
CAS number
2705-87-5SMILES
C=CCOC(=O)CCC1CCCCC1InChIKey
TWXUTZNBHUWMKJ-UHFFFAOYSA-NInChI
InChI=1S/C12H20O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2,11H,1,3-10H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- Cyclohexanepropanoic acid, 2-propen-1-yl ester
- Cyclohexanepropionic acid, allyl ester
- Cyclohexanepropanoic acid, 2-propenyl ester
- Ananolide
- 2-Propenyl 3-cyclohexylpropanoate
- Allyl 3-cyclohexylpropionate
- 2-Propenyl cyclohexanepropionate
- Allyl cyclohexylpropionate
- Allyl cyclohexanepropanoate
Work with Allyl cyclohexanepropionate
Similar compounds
1,6-Di-2-propen-1-yl hexanedioate2998-04-165 % similar
Allyl heptanoate142-19-857 % similar
Allyl butyrate2051-78-754 % similar
Allyl hexanoate123-68-254 % similar
Allyl propionate2408-20-049 % similar
2-Propen-1-yl 2-chloroacetate2916-14-549 % similar
Allyl amyl glycolate67634-00-845 % similar
Allyl acetoacetate1118-84-945 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds