trans-5-Amino-6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene - CAS 89140-85-2
Catalog: |
BB039352 |
Product Name: |
trans-5-Amino-6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene |
CAS: |
89140-85-2 |
Synonyms: |
5-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol; 5-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol |
IUPAC Name: | 5-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol |
Description: | trans-5-Amino-6-hydroxy-6,7,8,9-tetrahydro-5H-benzo[7]annulene (CAS# 89140-85-2 ) is a useful research chemical. |
Molecular Weight: | 177.24 |
Molecular Formula: | C11H15NO |
Canonical SMILES: | C1CC(C(C2=CC=CC=C2C1)N)O |
InChI: | InChI=1S/C11H15NO/c12-11-9-6-2-1-4-8(9)5-3-7-10(11)13/h1-2,4,6,10-11,13H,3,5,7,12H2 |
InChI Key: | BTRCHTMVMNPPSF-UHFFFAOYSA-N |
Boiling Point: | 325.62 °C at 760 mmHg |
Density: | 1.118 g/cm3 |
LogP: | 2.08390 |
Publication Number | Title | Priority Date |
EP-2920166-A1 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | 20121113 |
EP-2920166-B1 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | 20121113 |
US-10351575-B2 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | 20121113 |
US-2016355521-A1 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | 20121113 |
US-2019270749-A1 | Bicyclic urea, thiourea, guanidine and cyanoguanidine compounds useful for the treatment of pain | 20121113 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.115364102 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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