Pentyl p-hydroxybenzoate
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Pentyl p-hydroxybenzoate
structure -
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CAS No:
6521-29-5
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Formula:
C12H16O3
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Chemical Name:
Pentyl p-hydroxybenzoate
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Synonyms:
Benzoic acid,4-hydroxy-,pentyl ester;Benzoic acid,p-hydroxy-,pentyl ester;Pentyl 4-hydroxybenzoate;Pentyl p-hydroxybenzoate;Amyl p-hydroxybenzoate;n-Amyl 4-hydroxybenzoate;Pentyl paraben;NSC 309817;4-Hydroxybenzoic acid n-amyl ester
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CAS No:
Pentyl p-hydroxybenzoate Basic Attributes
208.25400
208.25
229-408-9
SJV2E4C7DM
309817
DTXSID9047887
2918290000
Characteristics
46.53000
2.73920
1.085±0.06 g/cm3(Predicted)
37-38°C
165-167 °C @ Press: 1.5 Torr
197-200°C/10mm
Insoluble in water. Slightly soluble in chloroform, methanol.
Safety Information
S24/25
DH2555000
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:208.25
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:208.109944368
Monoisotopic Mass:208.109944368
Topological Polar Surface Area:46.5
Heavy Atom Count:15
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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