HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 602000Generated: October 27, 2026
3-Amino-3-(4-ethoxy-3-methoxyphenyl)propanoic acid
RARECHEM AK HW 0246 · 3-(4-Ethoxy-3-methoxyphenyl)-beta-alanine · (R)-3-(1-aminopropyl)-5-fluorobenzonitrile · 3-ammonio-3-(4-ethoxy-3-methoxyphenyl)propanoate · 3-ammonio-3-(4-ethoxy-3-methoxy-phenyl)propionate · Benzenepropanoic acid, β-amino-4-ethoxy-3-methoxy- · 3-AMINO-3-(4-ETHOXY-3-METHOXYPHENYL)PROPANOIC ACID · 3-azaniumyl-3-(4-ethoxy-3-methoxyphenyl)propanoate
https://huagongshe.com/en/chemical/602000
Identifiers & Physical Properties
| CAS No. | 54503-18-3 |
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| Molecular formula | C12H17NO4 |
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| Average molar mass | 239.27 g/mol |
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| Monoisotopic mass | 239.11575802 g/mol |
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| SMILES | CCOc1ccc(C(N)CC(=O)O)cc1OC |
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| InChIKey | OOKYWAXNZYBZER-UHFFFAOYSA-N |
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| PubChem CID | 602000 |
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| DTXSID | DTXSID00345125 |
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Chemical & Physical Properties
| XLogP | -1.7 |
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| Topological polar surface area | 81.8 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 247 |
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| Melting point | 232-235°C |
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| Hazard class | IRRITANT |
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