(2-Hydroxyphenyl)acetic acid
Properties
- Molecular formula
- C8H8O3
- Molar mass
- 152.15 g/mol
- Exact mass
- 152.0473 Da
- Melting point
- 148 °C
- Boiling point
- 240 °C
- logP
- 1.02Crippen estimate
- Polar surface area
- 57.5 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98.7% of notifiers
Aggregated from 75 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
614-75-5SMILES
O=C(O)Cc1ccccc1OInChIKey
CCVYRRGZDBSHFU-UHFFFAOYSA-NInChI
InChI=1S/C8H8O3/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4,9H,5H2,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- (o-Hydroxyphenyl)acetic acid
- 2-HPAA
- NSC 62000
- 2-(2′-Hydroxyphenyl)acetic acid
- 2-(2-Hydroxyphenyl)acetic acid
- Benzeneacetic acid, 2-hydroxy-
- Acetic acid, (o-hydroxyphenyl)-
- 2-Hydroxybenzeneacetic acid
Work with (2-Hydroxyphenyl)acetic acid
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1,2-Benzenediacetic acid7500-53-073 % similar
2,5-Dihydroxy-1,4-benzenediacetic acid5488-16-468 % similar
Melilotic acid495-78-368 % similar
2-Bromophenylacetic acid18698-97-061 % similar
Homogentisic acid451-13-861 % similar
2-Iodophenylacetic acid18698-96-959 % similar
o-Chlorophenylacetic acid2444-36-259 % similar
2-Aminophenylacetic acid3342-78-759 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds