| CAS Number | 223763-91-5 |
| Catalog Number | AG01B6EJ |
| Chemical Name | tert-Butyl n-([1-(hydroxymethyl)cyclopentyl]methyl)carbamate |
| IUPAC Name | tert-butyl N-[[1-(hydroxymethyl)cyclopentyl]methyl]carbamate |
| InChI | InChI=1S/C12H23NO3/c1-11(2,3)16-10(15)13-8-12(9-14)6-4-5-7-12/h14H,4-9H2,1-3H3,(H,13,15) |
| InChI Key | SDHBGLHPHXJZBY-UHFFFAOYSA-N |
| MDL Number | MFCD20485947 |
| Molecular Formula | C12H23NO3 |
| Molecular Weight | 229.3159 |
| SMILES | C(=O)(OC(C)(C)C)C(C1(CCCC1)CO)N |
| Synonyms | 223763-91-5,
tert-butyl N-{[1-(hydroxymethyl)cyclopentyl]methyl}carbamate,
1-(Boc-aminomethyl)cyclopentanemethanol,
SCHEMBL7611276,
SDHBGLHPHXJZBY-UHFFFAOYSA-N,
AKOS017975215,
ZINC118825625,
MCULE-6459485844,
NS-02948,
tert-Butyl[1-(hydroxymethyl)cyclopentyl]methylcarbamate,
Z1716856357,
N-[tert-butoxycarbonyl] 1-aminomethyl-1-hydroxymethylcyclopentane,
tert-butyl (1-(hydroxymethyl)cyclopentyl)methylcarbamate,
tert-Butyl [1-(hydroxymethyl)cyclopentyl]methylcarbamate,
|
| Complexity | 239 |
| 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 | 5 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number