DBCO-amine - CAS 1255942-06-3
Catalog: |
BB006145 |
Product Name: |
DBCO-amine |
CAS: |
1255942-06-3 |
Synonyms: |
Azadibenzocyclooctyne-amine |
Molecular Weight: | 276.33 |
Molecular Formula: | C18H16N2O |
Canonical SMILES: | C1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCN |
InChI: | InChI=1S/C18H16N2O/c19-12-11-18(21)20-13-16-7-2-1-5-14(16)9-10-15-6-3-4-8-17(15)20/h1-8H,11-13,19H2 |
InChI Key: | OCCYFTDHSHTFER-UHFFFAOYSA-N |
Melting Point: | 86-96 °C |
Purity: | 95 % |
Solubility: | 10 mm in DMSO |
Appearance: | Slightly yellow to slightly crystalline |
Storage: | Store at -20 °C |
LogP: | 3.04710 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113476619-A | A kind of18F-labeled nano antibody probe and preparation method and application thereof | 20210708 |
JP-2021154125-A | Agents used for endometrial dissection | 20200325 |
WO-2021193707-A1 | Agent to be used in intraocular membrane detachment surgery | 20200325 |
WO-2021125255-A1 | Novel crosslinked alginic acid | 20191218 |
WO-2021125279-A1 | Chemically crosslinked alginate gel fiber | 20191218 |
Complexity: | 447 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 276.126263138 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 276.126263138 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Amines and Anilines
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