(2,4-Bis(1,1-dimethylpropyl)phenoxy)acetic acid
Properties
- Molecular formula
- C18H28O3
- Molar mass
- 292.42 g/mol
- Exact mass
- 292.2038 Da
- Melting point
- 116–117 °C
- logP
- 4.53Crippen estimate
- Polar surface area
- 46.5 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 7
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 72 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
13402-96-5SMILES
CCC(C)(C)c1ccc(OCC(=O)O)c(C(C)(C)CC)c1InChIKey
QXQMENSTZKYZCE-UHFFFAOYSA-NInChI
InChI=1S/C18H28O3/c1-7-17(3,4)13-9-10-15(21-12-16(19)20)14(11-13)18(5,6)8-2/h9-11H,7-8,12H2,1-6H3,(H,19,20)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]acetic acid
- Acetic acid, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-
- Acetic acid, (2,4-di-tert-pentylphenoxy)-
- Acetic acid, [2,4-bis(1,1-dimethylpropyl)phenoxy]-
- 2,4-Di-tert-amylphenoxyacetic acid
- 2-(2,4-Di-tert-amylphenoxy)acetic acid
- 2,4-Bis(1,1-dimethylpropyl)phenoxyacetic acid
- 2-(2,4-Di-tert-pentylphenoxy)aceticacid
- 2-[2,4-Bis(2-methylbutan-2-yl)phenoxy]acetic acid
- 2-(2,4-Di-tert-pentylphenoxy)acetic acid
Work with (2,4-Bis(1,1-dimethylpropyl)phenoxy)acetic acid
Similar compounds
4-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butanoic acid50772-35-574 % similar
2-[2,4-Bis(1,1-dimethylpropyl)phenoxy]butanoic acid13403-01-558 % similar
2,4-Di-tert-amylphenol120-95-649 % similar
2-[4-(1,1-Dimethylethyl)phenoxy]acetic acid1798-04-547 % similar
2,4-Xylyloxyacetic acid13334-49-145 % similar
1,2-Phenylenedioxydiacetic acid5411-14-344 % similar
MCPA94-74-643 % similar
2,4-Dibromophenoxyacetic acid10129-78-943 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds