1-Boc-3-aminoazetidine - CAS 193269-78-2
Catalog: |
BB014941 |
Product Name: |
1-Boc-3-aminoazetidine |
CAS: |
193269-78-2 |
Synonyms: |
3-amino-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-aminoazetidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-aminoazetidine-1-carboxylate |
Description: | 1-Boc-3-aminoazetidine (CAS# 193269-78-2) is a compound useful in organic synthesis. |
Molecular Weight: | 172.22 |
Molecular Formula: | C8H16N2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(C1)N |
InChI: | InChI=1S/C8H16N2O2/c1-8(2,3)12-7(11)10-4-6(9)5-10/h6H,4-5,9H2,1-3H3 |
InChI Key: | WPGLRFGDZJSQGI-UHFFFAOYSA-N |
Boiling Point: | 236.6 °C at 760 mmHg |
Density: | 1.098 g/cm3 |
LogP: | 1.20260 |
GHS Hazard Statement: | H315 (96.55%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.121177757 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.121177757 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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Amines and Anilines
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