1-Acetyl-3-azetidinecarboxylic Acid - CAS 97628-91-6
Catalog: |
BB042064 |
Product Name: |
1-Acetyl-3-azetidinecarboxylic Acid |
CAS: |
97628-91-6 |
Synonyms: |
1-acetyl-3-azetidinecarboxylic acid; 1-acetylazetidine-3-carboxylic acid |
IUPAC Name: | 1-acetylazetidine-3-carboxylic acid |
Description: | 1-Acetyl-3-azetidinecarboxylic Acid (CAS# 97628-91-6) is a useful research chemical. |
Molecular Weight: | 143.14 |
Molecular Formula: | C6H9NO3 |
Canonical SMILES: | CC(=O)N1CC(C1)C(=O)O |
InChI: | InChI=1S/C6H9NO3/c1-4(8)7-2-5(3-7)6(9)10/h5H,2-3H2,1H3,(H,9,10) |
InChI Key: | YFWJZEMJJMOQAC-UHFFFAOYSA-N |
Storage: | Sealed in dry, Store in freezer, under -20 °C |
MDL: | MFCD12406968 |
LogP: | -0.51280 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021175200-A1 | Ferroptosis inhibitorsâ€"diarylamine para-acetamides | 20200302 |
WO-2021062246-A1 | Crf receptor antagonists and methods of use | 20190927 |
CN-112165940-A | OX2R compound | 20180327 |
JP-2021519776-A | OX2R compound | 20180327 |
CA-3063809-A1 | Compounds | 20170517 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.058243149 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 57.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1 |
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