| CAS Number | 1393180-29-4 |
| Catalog Number | AG00IL10(AGN-PC-0WNWPF) |
| Chemical Name | Tert-Butyl N-(3-Cyanocyclobutyl)Carbamate |
| IUPAC Name | tert-butyl N-(3-cyanocyclobutyl)carbamate |
| InChI | InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)12-8-4-7(5-8)6-11/h7-8H,4-5H2,1-3H3,(H,12,13) |
| InChI Key | QCUKEYZJVYABFL-UHFFFAOYSA-N |
| MDL Number | MFCD28524621 |
| Molecular Formula | C10H16N2O2 |
| Molecular Weight | 196.2462 |
| SMILES | N#CC1CC(C1)NC(=O)OC(C)(C)C |
| Synonyms | tert-butyl N-(3-cyanocyclobutyl)carbamate,
1393180-29-4,
SCHEMBL11901886,
QCUKEYZJVYABFL-ZKCHVHJHSA-N,
MFCD28524621,
AKOS024070522,
SB22366,
t-Butyl N-(3-cyanocyclobutyl)carbamate,
AS-54250,
CS-0048079,
tert-butyl (trans-3-cyanocyclobutyl)carbamate,
tert-butyl N-[(1r,3r)-3-cyanocyclobutyl]carbamate, trans,
1799727-32-4,
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| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.25g/mol |
| Monoisotopic Mass | 196.121g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 62.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number