6-Amino-7-Methoxy-1H-benzimidazol - CAS 1360962-27-1
Catalog: |
BB074334 |
Product Name: |
6-Amino-7-Methoxy-1H-benzimidazol |
CAS: |
1360962-27-1 |
Synonyms: |
5-Amino-4-methoxy-1H-benzimidazole |
IUPAC Name: | 4-methoxy-1H-benzimidazol-5-amine |
Molecular Weight: | 163.18 |
Molecular Formula: | C8H9N3O |
Canonical SMILES: | COC1=C(C=CC2=C1N=CN2)N |
InChI: | InChI=1S/C8H9N3O/c1-12-8-5(9)2-3-6-7(8)11-4-10-6/h2-4H,9H2,1H3,(H,10,11) |
InChI Key: | JLNGMRPPUPNVQJ-UHFFFAOYSA-N |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.074561919 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.074561919 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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