endo-3-Amino-9-methyl-9-azabicyclo[3,3,1]nonane - CAS 76272-56-5
Catalog: |
BB035539 |
Product Name: |
endo-3-Amino-9-methyl-9-azabicyclo[3,3,1]nonane |
CAS: |
76272-56-5 |
Synonyms: |
(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine; (1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine |
IUPAC Name: | (1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine |
Description: | Granisetron impurity E. An intermediate of Granisetron. |
Molecular Weight: | 154.25 |
Molecular Formula: | C9H18N2 |
Canonical SMILES: | CN1C2CCCC1CC(C2)N |
InChI: | InChI=1S/C9H18N2/c1-11-8-3-2-4-9(11)6-7(10)5-8/h7-9H,2-6,10H2,1H3/t7?,8-,9+ |
InChI Key: | HTZWHTQVHWHSHN-CBLAIPOGSA-N |
Boiling Point: | 115-119 °C (18 mmHg) |
Density: | 0.968 g/cm3 |
Appearance: | Colorless or light yellow clear liquid |
LogP: | 1.59860 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113354651-A | Pyrazolo [1,5-a ] quinazoline derivative and application thereof in preparation of medicines | 20200730 |
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Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 154.146998583 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 154.146998583 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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Amines and Anilines
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