| CAS Number | 206446-46-0 |
| Catalog Number | AG002IHZ(AGN-PC-0WCL8L) |
| Chemical Name | 1-Azetidinecarboxylic acid, 3-(2-propen-1-yl)-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 3-prop-2-enylazetidine-1-carboxylate |
| InChI | InChI=1S/C11H19NO2/c1-5-6-9-7-12(8-9)10(13)14-11(2,3)4/h5,9H,1,6-8H2,2-4H3 |
| InChI Key | NRVSFSWUHOREJA-UHFFFAOYSA-N |
| MDL Number | MFCD24473931 |
| Molecular Formula | C11H19NO2 |
| Molecular Weight | 197.2741 |
| SMILES | O=C(N1CC(CC=C)C1)OC(C)(C)C |
| Synonyms | 206446-46-0,
1-Boc-3-allylazetidine,
tert-Butyl 3-allylazetidine-1-carboxylate,
tert-butyl 3-(prop-2-en-1-yl)azetidine-1-carboxylate,
Tert-butyl 3-prop-2-enylazetidine-1-carboxylate,
KS-000004OH,
MFCD24473931,
ZINC36404817,
FCH1667300,
SB12499,
AK171076,
AS-51944,
CS-0048357,
3-Allyl-1-azetidinecarboxylic acid tert-butyl ester,
1-Azetidinecarboxylic acid, 3-(2-propen-1-yl)-, 1,1-dimethylethyl ester,
CID11745599,
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| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.278g/mol |
| Monoisotopic Mass | 197.142g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number