1,3-Benzoxazol-6-ol - CAS 106050-81-1
Catalog: |
BB073128 |
Product Name: |
1,3-Benzoxazol-6-ol |
CAS: |
106050-81-1 |
Synonyms: |
1,3-benzoxazol-6-ol; benzo[d]oxazol-6-ol; 6-Benzoxazolol; 6-hydroxybenzoxazole; Benzoxazol-6-ol |
IUPAC Name: | 1,3-benzoxazol-6-ol |
Description: | 1,3-benzoxazol-6-ol (cas# 106050-81-1) is a useful research chemical. |
Molecular Weight: | 135.12 |
Molecular Formula: | C7H5NO2 |
Canonical SMILES: | C1=CC2=C(C=C1O)OC=N2 |
InChI: | InChI=1S/C7H5NO2/c9-5-1-2-6-7(3-5)10-4-8-6/h1-4,9H |
InChI Key: | SAHAKBXWZLDNAA-UHFFFAOYSA-N |
Solubility: | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
Appearance: | Dark Brown Solid |
Storage: | -20°C, Inert atmosphere |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 135.032028402 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 135.032028402 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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