2-Amino-5-methoxybenzoxazole - CAS 64037-14-5
Catalog: |
BB032352 |
Product Name: |
2-Amino-5-methoxybenzoxazole |
CAS: |
64037-14-5 |
Synonyms: |
5-methoxy-1,3-benzoxazol-2-amine; 5-methoxy-1,3-benzoxazol-2-amine |
IUPAC Name: | 5-methoxy-1,3-benzoxazol-2-amine |
Description: | 2-Amino-5-methoxybenzoxazole (CAS# 64037-14-5) is a useful research chemical. |
Molecular Weight: | 164.16 |
Molecular Formula: | C8H8N2O2 |
Canonical SMILES: | COC1=CC2=C(C=C1)OC(=N2)N |
InChI: | InChI=1S/C8H8N2O2/c1-11-5-2-3-7-6(4-5)10-8(9)12-7/h2-4H,1H3,(H2,9,10) |
InChI Key: | YCBIFQTZAQVLTQ-UHFFFAOYSA-N |
Boiling Point: | 320.2 °C at 760 mmHg |
Density: | 1.304 g/cm3 |
LogP: | 1.99980 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2016213030-A1 | Preventive and/or therapeutic agent of immune disease | 20150130 |
AU-2016213030-B2 | Preventive and/or therapeutic agent of immune disease | 20150130 |
CA-2975372-A1 | Preventive and/or therapeutic agent of immune disease | 20150130 |
CA-2975372-C | Preventive and/or therapeutic agent of immune disease | 20150130 |
EP-3120852-A1 | Prophylactic and/or therapeutic agent for immune diseases | 20150130 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.058577502 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 61.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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