1H-Imidazole-5-acetic acid
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1H-Imidazole-5-acetic acid
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CAS No:
645-65-8
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Formula:
C5H6N2O2
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Chemical Name:
1H-Imidazole-5-acetic acid
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Synonyms:
1H-Imidazole-5-acetic acid;Imidazole-4-acetic acid;1H-Imidazole-4-acetic acid;Imidazole-4(or 5)-acetic acid;Imidazoleacetic acid;(Imidazol-4-yl)acetic acid;Imidazol-4(5)-ylacetic acid;NSC 60104;(3H-Imidazol-4-yl)acetic acid;I-4-AA;4-(Carboxymethyl)-1H-imidazole;(1H-Imidazol-4-yl)acetic acid;2-(1H-Imidazol-5-yl)acetic acid;Imidazole-5-acetic acid;2-(1H-Imidazol-4-yl)acetic acid;5-(2-Carboxymethyl)imidazole;873-79-0
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CAS No:
Description
Imidazoleacetic acid is an endogenous ligand that stimulates imidazole receptors.
Solid
Imidazol-4-ylacetic acid is a monocarboxylic acid that is acetic acid in which one of the methyl hydrogens has been replaced by an imidazol-4-yl group. It has a role as a mouse metabolite. It is a monocarboxylic acid and a member of imidazoles. It derives from an acetic acid. It is a conjugate acid of an imidazol-4-ylacetate. It is a tautomer of an imidazol-5-ylacetic acid and a 2H-imidazol-4-ylacetic acid.
1H-Imidazole-5-acetic acid Basic Attributes
126.11300
126.11
IGZ30Z24EJ
60104
DTXSID50214751
2933290090
Characteristics
65.98000
0.03680
Solid
1.426 g/cm3
217-219 °C (decomp)
447.343ºC at 760 mmHg
123.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]|128.23 Ų [M+H]+ [CCS Type: DT, Method: stepped-field]|148.03 Ų [M+Na]+ [CCS Type: DT, Method: stepped-field]|123.9 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Safety Information
|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:126.11
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:126.042927438
Monoisotopic Mass:126.042927438
Topological Polar Surface Area:66
Heavy Atom Count:9
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 1H-Imidazole-5-acetic acid
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Business licensed Certified factoryManufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acidInquiryCAS No.: 645-65-8Grade: Industrial GradeContent: 95%
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