2-(2H-Benzotriazol-2-yl)-6-(isobuten-1-yl)-p-cresol - CAS 2170-37-8
Catalog: |
BB061632 |
Product Name: |
2-(2H-Benzotriazol-2-yl)-6-(isobuten-1-yl)-p-cresol |
CAS: |
2170-37-8 |
Synonyms: |
2-(2H-Benzotriazol-2-yl)-6-(isobuten-1-yl)-p-cresol; 2-(Benzotriazol-2-yl)-4-methyl-6-(2-methylprop-1-enyl)phenol |
IUPAC Name: | 2-(benzotriazol-2-yl)-4-methyl-6-(2-methylprop-1-enyl)phenol |
Molecular Weight: | 279.34 |
Molecular Formula: | C17H17N3O |
Canonical SMILES: | CC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)C=C(C)C |
InChI: | InChI=1S/C17H17N3O/c1-11(2)8-13-9-12(3)10-16(17(13)21)20-18-14-6-4-5-7-15(14)19-20/h4-10,21H,1-3H3 |
InChI Key: | PBZOYZUSEXWJBP-UHFFFAOYSA-N |
Complexity: | 380 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 279.137162174 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 279.137162174 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.9 |
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