2-[4-(1,1-Dimethylethyl)phenoxy]acetic acid
Properties
- Molecular formula
- C12H16O3
- Molar mass
- 208.26 g/mol
- Exact mass
- 208.1099 Da
- Melting point
- 80 °C
- logP
- 2.45Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation97.8% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 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
1798-04-5SMILES
CC(C)(C)c1ccc(OCC(=O)O)cc1InChIKey
FBIGAJNVRFKBJL-UHFFFAOYSA-NInChI
InChI=1S/C12H16O3/c1-12(2,3)9-4-6-10(7-5-9)15-8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Acetic acid, 2-[4-(1,1-dimethylethyl)phenoxy]-
- Acetic acid, (p-tert-butylphenoxy)-
- Acetic acid, [4-(1,1-dimethylethyl)phenoxy]-
- 4-tert-Butylphenoxyacetic acid
- (p-tert-Butylphenoxy)acetic acid
- NSC 8481
- [(4-tert-Butylphenyl)oxy]acetic acid
- 2-(4-(tert-Butyl)phenoxy)acetic acid
- 2-(4-tert-Butylphenoxy)acetic acid
Work with 2-[4-(1,1-Dimethylethyl)phenoxy]acetic acid
Similar compounds
2,2′-[1,4-Phenylenebis(oxy)]bis[acetic acid]2245-53-670 % similar
4-Methoxyphenoxyacetic acid1877-75-463 % similar
4-(1,1-Dimethylethyl)benzeneacetic acid32857-63-963 % similar
(4-Methylphenoxy)acetic acid940-64-763 % similar
(4-Hydroxyphenoxy)acetic acid1878-84-860 % similar
2-(4-(Trifluoromethoxy)phenoxy)acetic acid72220-50-959 % similar
Phenoxyacetic acid122-59-859 % similar
4-Chlorophenoxyacetic acid122-88-358 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds