1H-Imidazole-5-propanoic acid
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1H-Imidazole-5-propanoic acid
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CAS No:
1074-59-5
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Formula:
C6H8N2O2
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Chemical Name:
1H-Imidazole-5-propanoic acid
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Synonyms:
1H-Imidazole-5-propanoic acid;Imidazole-4-propionic acid;1H-Imidazole-4-propanoic acid;Imidazole-4(or 5)-propionic acid;3-(4-Imidazolyl)propionic acid;β-Imidazolyl-4(5)-propionic acid;Dihydrourocanic acid;β-(5-Imidazolyl)propionic acid;Imidazolylpropionic acid;3-(Imidazol-4(5)-yl)propionic acid;Dihydrourocanoic acid;1H-Imidazole-4-propionic acid;3-(1H-4-Imidazolyl)propanoic acid;NSC 66737;3-(1H-Imidazol-4-yl)propionic acid;5-(2-Carboxyethyl) imidazole;3724-24-1
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CAS No:
Description
Solid
Solid
Dihydrourocanic acid is a monocarboxylic acid that is propionic acid in which one of the hydrogens at position 3 has been replaced by an imidazol-4-yl group. It is a member of imidazoles and a monocarboxylic acid. It derives from a propionic acid. It is a conjugate acid of a dihydrourocanate.
1H-Imidazole-5-propanoic acid Basic Attributes
140.14
140.14
214-045-0
8B1241598D
66737
DTXSID30148040
2933290090
Characteristics
66
-0.3
Solid
1.335g/cm3
206-208 °C
427.4°C at 760 mmHg
212.3ºC
1.571
-15ºC
4.57E-08mmHg at 25°C
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 195 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:140.14
XLogP3:-0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:140.058577502
Monoisotopic Mass:140.058577502
Topological Polar Surface Area:66
Heavy Atom Count:10
Complexity:127
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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