| CAS Number | 36668-76-5 |
| Catalog Number | AG00BYZV(AGN-PC-0L6Q60) |
| Chemical Name | tert-butyl(cyano)amine |
| IUPAC Name | tert-butylcyanamide |
| InChI | InChI=1S/C5H10N2/c1-5(2,3)7-4-6/h7H,1-3H3 |
| InChI Key | IBQCYUBVFOFMRI-UHFFFAOYSA-N |
| MDL Number | MFCD03939095 |
| Molecular Formula | C5H10N2 |
| Molecular Weight | 98.1463 |
| SMILES | CC(NC#N)(C)C |
| Synonyms | Tert-butylcyanamide,
36668-76-5,
tert-butyl(cyano)amine,
N-(tert-butyl)cyanamide,
t-butylcyanamide,
AC1N4IDI,
TERT-BUTYL CYANAMIDE,
AC1Q1ML0,
CTK7D0785,
Cyanamide, (1,1-dimethylethyl)-,
ZINC6692911,
7313AF,
AKOS011772350,
MCULE-5438915876,
Cyanamide,(1,1-dimethylethyl)-,
C5H10N2,
CID4179348,
|
| Complexity | 90.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 98.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 98.149g/mol |
| Monoisotopic Mass | 98.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number