| CAS Number | 816429-99-9 |
| Catalog Number | AG00G3Q2(AGN-PC-0UKEXF) |
| Chemical Name | tert-Butyl 1-cyclobutyl-3-hydroxypropan-2-ylcarbamate |
| EC Number | 617-249-1 |
| IUPAC Name | tert-butyl N-(1-cyclobutyl-3-hydroxypropan-2-yl)carbamate |
| InChI | InChI=1S/C12H23NO3/c1-12(2,3)16-11(15)13-10(8-14)7-9-5-4-6-9/h9-10,14H,4-8H2,1-3H3,(H,13,15) |
| InChI Key | YAYOAQZEBASQLZ-UHFFFAOYSA-N |
| MDL Number | MFCD14584910 |
| Molecular Formula | C12H23NO3 |
| Molecular Weight | 229.3159 |
| SMILES | O=C(OC(C)(C)C)NC(CO)CC1CCC1 |
| Synonyms | 816429-99-9,
tert-butyl [2-cyclobutyl-1-(hydroxymethyl)ethyl]carbamate,
tert-Butyl 1-cyclobutyl-3-hydroxypropan-2-ylcarbamate,
tert-butyl (1-cyclobutyl-3-hydroxypropan-2-yl)carbamate,
SCHEMBL1155264,
DTXSID90466550,
CS-M1157,
4098AH,
AKOS015957662,
MCULE-4854527173,
CS-13811,
VU0549316-1,
L-3247,
F9995-0195,
tert-butyl N-(1-cyclobutyl-3-hydroxypropan-2-yl)carbamate,
C12H23NO3,
CID11458859,
Tert-butyl N-(1-cyclobutyl-3-hydroxy-propan-2-yl)carbamate,
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| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.32g/mol |
| Monoisotopic Mass | 229.168g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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