p-Hydroxybenzoate
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p-Hydroxybenzoate
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CAS No:
456-23-5
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Formula:
C7H5O3
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Chemical Name:
p-Hydroxybenzoate
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Synonyms:
Benzoic acid,4-hydroxy-,ion(1-);Benzoic acid,p-hydroxy-,ion(1-);p-Hydroxybenzoate;p-Hydroxybenzoic acid monoanion;p-Hydroxybenzoic acid ion(1-);4-Hydroxybenzoate;4-Hydroxybenzoate ion;p-Hydroxybenzoate anion;p-Hydroxybenzenecarboxylic acid
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CAS No:
Description
ChEBI: The conjugate base of 4-hydroxybenzoic acid, comprising a 4-hydroxybenzoic acid core with a proton missing to give a charge of -1.
4-hydroxybenzoate is the conjugate base of 4-hydroxybenzoic acid, comprising a 4-hydroxybenzoic acid core with a proton missing to give a charge of -1. It has a role as a plant metabolite and a Saccharomyces cerevisiae metabolite. It derives from a benzoate. It is a conjugate base of a 4-hydroxybenzoic acid.
Characteristics
60.4
2.5
336.2ºC at 760mmHg
171.3ºC
119 Ų [M+H-H2O]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|119.33 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|121.2 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Computed Properties
Molecular Weight:137.11
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:137.023869017
Monoisotopic Mass:137.023869017
Topological Polar Surface Area:60.4
Heavy Atom Count:10
Formal Charge:-1
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Learn More Other Chemicals
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Octyl p-hydroxybenzoate
1219-38-1
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Heptyl p-hydroxybenzoate
1085-12-7
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Pentyl p-hydroxybenzoate
6521-29-5
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Sodium p-hydroxybenzoate Formula
114-63-6