Benzotriazol-1-YL 9-Fluorenylmethyl Carbonate - CAS 82911-71-5
Catalog: |
BB036936 |
Product Name: |
Benzotriazol-1-YL 9-Fluorenylmethyl Carbonate |
CAS: |
82911-71-5 |
Synonyms: |
benzotriazol-1-yl 9H-fluoren-9-ylmethyl carbonate; (9H-Fluoren-9-yl)methyl 1H-benzo[d][1,2,3]triazol-1-yl carbonate; Fmoc-OBt; 9-Fluorenylmethyl 1-benzotriazolyl carbonate; 1-Benzotriazolyl (9-Fluorenyl)methyl Carbonate; 1-(Fmoc-oxy)benzotriazole; Fmoc-OBT |
IUPAC Name: | benzotriazol-1-yl 9H-fluoren-9-ylmethyl carbonate |
Description: | Benzotriazol-1-YL 9-Fluorenylmethyl Carbonate (CAS# 82911-71-5) is a useful research chemical. |
Molecular Weight: | 357.36 |
Molecular Formula: | C21H15N3O3 |
Canonical SMILES: | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)ON4C5=CC=CC=C5N=N4 |
InChI: | InChI=1S/C21H15N3O3/c25-21(27-24-20-12-6-5-11-19(20)22-23-24)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-12,18H,13H2 |
InChI Key: | KNSPZTVPSAKHBN-UHFFFAOYSA-N |
Boiling Point: | 536.1 °C at 760 mmHg |
Melting Point: | 178 °C (dec.) |
Purity: | 99 % (HPLC) |
Density: | 1.380 g/cm3 |
Appearance: | White powder |
Storage: | 2-8 °C |
MDL: | MFCD00074939 |
LogP: | 3.80900 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-110452158-B | Method for synthesizing halofuginone with optical activity and intermediate thereof | 20190130 |
CN-110452157-B | Method for synthesizing halofuginone and intermediate thereof | 20181228 |
WO-2020134212-A1 | Synthesis method for halofuginone and intermediate thereof | 20181228 |
JP-6772401-B2 | Coating particles | 20180710 |
JP-WO2020012962-A1 | Coating particles | 20180710 |
Complexity: | 523 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 357.11134135 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 357.11134135 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 66.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.8 |
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