4-(Pentyloxy)benzoic acid
Properties
- Molecular formula
- C12H16O3
- Molar mass
- 208.26 g/mol
- Exact mass
- 208.1099 Da
- Melting point
- 148 °C
- logP
- 2.95Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 6
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
15872-41-0SMILES
CCCCCOc1ccc(C(=O)O)cc1InChIKey
OZPPUPJQRJYTNY-UHFFFAOYSA-NInChI
InChI=1S/C12H16O3/c1-2-3-4-9-15-11-7-5-10(6-8-11)12(13)14/h5-8H,2-4,9H2,1H3,(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Benzoic acid, 4-(pentyloxy)-
- Benzoic acid, p-(pentyloxy)-
- Benzoic acid, p-amoxy-
- p-Pentoxybenzoic acid
- p-n-Pentyloxybenzoic acid
- p-(Pentyloxy)benzoic acid
- p-Amyloxybenzoic acid
- p-(n-Pentoxy)benzoic acid
- 4-Pentoxybenzoic acid
- NSC 71397
Work with 4-(Pentyloxy)benzoic acid
Similar compounds
4-(Hexyloxy)benzoic acid1142-39-897 % similar
4-(Heptyloxy)benzoic acid15872-42-197 % similar
4-(Nonyloxy)benzoic acid15872-43-297 % similar
4-Undecyloxybenzoic acid15872-44-397 % similar
4-(Dodecyloxy)benzoic acid2312-15-497 % similar
Octyloxybenzoic acid2493-84-797 % similar
4-(Decyloxy)benzoic acid5519-23-397 % similar
4-Butoxybenzoic acid1498-96-091 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds