| CAS Number | 479079-15-7 |
| Catalog Number | AG00DKI7(AGN-PC-0RXCWK) |
| Chemical Name | tert-Butyl (N-hydroxycarbamimidoylmethyl)carbamate |
| IUPAC Name | tert-butyl N-(2-amino-2-hydroxyiminoethyl)carbamate |
| InChI | InChI=1S/C7H15N3O3/c1-7(2,3)13-6(11)9-4-5(8)10-12/h12H,4H2,1-3H3,(H2,8,10)(H,9,11) |
| InChI Key | HPWSTQITVJEUMH-UHFFFAOYSA-N |
| MDL Number | MFCD11052410 |
| Molecular Formula | C7H15N3O3 |
| Molecular Weight | 189.2123 |
| SMILES | C(=O)(OC(C)(C)C)NC/C(/N)=N/O |
| Synonyms | 479079-15-7,
tert-Butyl (2-(hydroxyamino)-2-iminoethyl)carbamate,
479080-20-1,
tert-butyl [(2E)-2-amino-2-(hydroxyimino)ethyl]carbamate,
AKOS017417390,
AJ-98273,
N'-Hydroxy-2-(tert-butoxycarbonylamino)acetamidine,
tert-butyl N-[(2Z)-2-amino-2-hydroxyiminoethyl]carbamate,
Carbamic acid, [(2Z)-2-(hydroxyamino)-2-iminoethyl]-, 1,1-dimethylethyl ester,
Carbamic acid, [2-(hydroxyamino)-2-iminoethyl]-, 1,1-dimethylethyl ester (9CI),
tert-butyl 2-amino-2-(hydroxyimino)ethylcarbamate,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.215g/mol |
| Monoisotopic Mass | 189.111g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 96.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P280-P301+P312-P302+P352-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number