| CAS Number | 17321-94-7 |
| Catalog Number | AG001YPQ(AGN-PC-0WB0NZ) |
| Chemical Name | 4-tert-Butylpyrimidin-2-amine |
| IUPAC Name | 4-tert-butylpyrimidin-2-amine |
| InChI | InChI=1S/C8H13N3/c1-8(2,3)6-4-5-10-7(9)11-6/h4-5H,1-3H3,(H2,9,10,11) |
| InChI Key | OKLVXPSKPCTBGL-UHFFFAOYSA-N |
| MDL Number | MFCD01646229 |
| Molecular Formula | C8H13N3 |
| Molecular Weight | 151.2089 |
| SMILES | CC(C1=NC(N)=NC=C1)(C)C |
| Synonyms | 4-tert-butylpyrimidin-2-amine,
17321-94-7,
4-(tert-Butyl)pyrimidin-2-amine,
2-amino-4-tert-butylpyrimidine,
tertbutylpyrimidinamine,
SCHEMBL179501,
CHEMBL3251581,
DTXSID20498804,
4-tert-butyl-pyrimidin-2-ylamine,
OKLVXPSKPCTBGL-UHFFFAOYSA-N,
KS-000027DT,
5577AD,
MFCD01646229,
ZINC40537999,
AKOS011765313,
KF-0744,
MCULE-8894216668,
RP10017,
AJ-103380,
J-513871,
C8H13N3,
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| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 151.213g/mol |
| Monoisotopic Mass | 151.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number