2-Amino-4-(2-methyl-4-nitrophenoxy)pyridine - CAS 864244-98-4
Catalog: |
BB037920 |
Product Name: |
2-Amino-4-(2-methyl-4-nitrophenoxy)pyridine |
CAS: |
864244-98-4 |
Synonyms: |
4-(2-methyl-4-nitrophenoxy)-2-pyridinamine; 4-(2-methyl-4-nitrophenoxy)pyridin-2-amine |
IUPAC Name: | 4-(2-methyl-4-nitrophenoxy)pyridin-2-amine |
Description: | 2-Amino-4-(2-methyl-4-nitrophenoxy)pyridine (CAS# 864244-98-4 ) is a useful research chemical. |
Molecular Weight: | 245.23 |
Molecular Formula: | C12H11N3O3 |
Canonical SMILES: | CC1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC(=NC=C2)N |
InChI: | InChI=1S/C12H11N3O3/c1-8-6-9(15(16)17)2-3-11(8)18-10-4-5-14-12(13)7-10/h2-7H,1H3,(H2,13,14) |
InChI Key: | ZZTYDAVBBQOEOR-UHFFFAOYSA-N |
LogP: | 3.77710 |
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Complexity: | 295 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.08004122 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.08004122 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 94 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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