2-methyl-1,3-benzoxazol-5-amine - CAS 72745-76-7
Catalog: |
BB034678 |
Product Name: |
2-methyl-1,3-benzoxazol-5-amine |
CAS: |
72745-76-7 |
Synonyms: |
2-methyl-1,3-benzoxazol-5-amine; 2-methyl-1,3-benzoxazol-5-amine |
IUPAC Name: | 2-methyl-1,3-benzoxazol-5-amine |
Description: | 2-methyl-1,3-benzoxazol-5-amine (CAS# 72745-76-7) is a useful research chemical. |
Molecular Weight: | 148.16 |
Molecular Formula: | C8H8N2O |
Canonical SMILES: | CC1=NC2=C(O1)C=CC(=C2)N |
InChI: | InChI=1S/C8H8N2O/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,9H2,1H3 |
InChI Key: | FECYTFWPNCBIHC-UHFFFAOYSA-N |
Boiling Point: | 290.6 ℃ at 760 mmHg |
Melting Point: | 50-53 ℃ |
Purity: | 95 % |
Density: | 1.254 g/cm3 |
MDL: | MFCD00628970 |
LogP: | 2.29960 |
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 |
CN-113164476-A | Small molecule inhibitor of DYRK1/CLK and application thereof | 20180928 |
US-2020039989-A1 | Small molecule inhibitors of dyrk/clk and uses thereof | 20180301 |
EP-3301097-A2 | [1]benzothieno[3',2':4,5]imidazo[1,2-a]pyridine derivatives and related compounds for use in organic light-emitting devices (oleds) | 20160930 |
EP-3693372-A1 | Benzofuro[3',2':4,5]imidazo[1,2-a]pyridine derivatives and related compounds for use in organic light-emitting devices (oleds) | 20160930 |
EP-3244466-A1 | Organic light-emitting device | 20160510 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.063662883 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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