6-Amino-5-methyl-1,4-benzodioxane - CAS 185312-08-7
Catalog: |
BB014219 |
Product Name: |
6-Amino-5-methyl-1,4-benzodioxane |
CAS: |
185312-08-7 |
Synonyms: |
5-methyl-2,3-dihydro-1,4-benzodioxin-6-amine; 5-methyl-2,3-dihydro-1,4-benzodioxin-6-amine |
IUPAC Name: | 5-methyl-2,3-dihydro-1,4-benzodioxin-6-amine |
Description: | 6-Amino-5-methyl-1,4-benzodioxane (CAS# 185312-08-7 ) is a useful research chemical. |
Molecular Weight: | 165.19 |
Molecular Formula: | C9H11NO2 |
Canonical SMILES: | CC1=C(C=CC2=C1OCCO2)N |
InChI: | InChI=1S/C9H11NO2/c1-6-7(10)2-3-8-9(6)12-5-4-11-8/h2-3H,4-5,10H2,1H3 |
InChI Key: | IPMFOFCGVPPCOD-UHFFFAOYSA-N |
LogP: | 1.92960 |
Publication Number | Title | Priority Date |
EP-2970106-B1 | Boron-containing diacylhydrazines | 20130315 |
US-5914342-A | 2-imidazolinylamino heterocyclic compounds useful as alpha-2 adrenoceptor agonists | 19950607 |
US-5663189-A | 2-imidazolinylamino heterocyclic compounds useful as alpha-2 adrenoceptor agonists | 19930701 |
US-5965595-A | 2-Imidazolinylamino heterocyclic compounds useful as alpha-2 adrenoceptor agonists | 19930701 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.078978594 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 44.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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