2-Amino-4-[(Boc-amino)methyl]pyrimidine - CAS 1338651-80-1
Catalog: |
BB007827 |
Product Name: |
2-Amino-4-[(Boc-amino)methyl]pyrimidine |
CAS: |
1338651-80-1 |
Synonyms: |
N-[(2-amino-4-pyrimidinyl)methyl]carbamic acid tert-butyl ester; tert-butyl N-[(2-aminopyrimidin-4-yl)methyl]carbamate |
IUPAC Name: | tert-butyl N-[(2-aminopyrimidin-4-yl)methyl]carbamate |
Description: | 2-Amino-4-[(Boc-amino)methyl]pyrimidine (CAS# 1338651-80-1 ) is a useful research chemical. |
Molecular Weight: | 224.26 |
Molecular Formula: | C10H16N4O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1=NC(=NC=C1)N |
InChI: | InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)13-6-7-4-5-12-8(11)14-7/h4-5H,6H2,1-3H3,(H,13,15)(H2,11,12,14) |
InChI Key: | RADYSDZDQYQKRV-UHFFFAOYSA-N |
Complexity: | 240 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 224.12732577 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 224.12732577 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 90.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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