1-Boc-azetidine-2-carbaldehyde - CAS 852324-38-0
Catalog: |
BB037544 |
Product Name: |
1-Boc-azetidine-2-carbaldehyde |
CAS: |
852324-38-0 |
Synonyms: |
2-formyl-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 2-formylazetidine-1-carboxylate |
IUPAC Name: | tert-butyl 2-formylazetidine-1-carboxylate |
Description: | 1-Boc-azetidine-2-carbaldehyde (CAS# 852324-38-0) is a useful research chemical. |
Molecular Weight: | 185.22 |
Molecular Formula: | C9H15NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC1C=O |
InChI: | InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)10-5-4-7(10)6-11/h6-7H,4-5H2,1-3H3 |
InChI Key: | UEGGEIJWHPDPLL-UHFFFAOYSA-N |
LogP: | 1.13260 |
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-2020148619-A1 | Novel substituted sulfonylurea derivatives | 20190114 |
CN-113474333-A | Novel substituted sulfonylurea derivatives | 20190114 |
KR-20210114967-A | Novel Substituted Sulfonylurea Derivatives | 20190114 |
CA-3098272-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
CA-3104928-A1 | New heterocyclic compounds as monoacylglycerol lipase inhibitors | 20180813 |
Complexity: | 219 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.10519334 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.6 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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