200,000+ products from a single source!
sales@angenechem.com
18966-64-8 | Phenol, 2-bromo-4-(1,1-dimethylpropyl)-
CAS No: 18966-64-8 Catalog No: AG002DUZ MDL No:
Product Description
Catalog Number:
AG002DUZ
Chemical Name:
Phenol, 2-bromo-4-(1,1-dimethylpropyl)-
CAS Number:
18966-64-8
Molecular Formula:
C11H15BrO
Molecular Weight:
243.1402
IUPAC Name:
2-bromo-4-(2-methylbutan-2-yl)phenol
InChI:
InChI=1S/C11H15BrO/c1-4-11(2,3)8-5-6-10(13)9(12)7-8/h5-7,13H,4H2,1-3H3
InChI Key:
LTEAOSLAFBPTDU-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(c(c1)Br)O)(C)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.144g/mol
Monoisotopic Mass:
242.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| Structural identification of extractables from rubber closures used for pre-filled semisolid drug applicator by chromatography, mass spectrometry, and organic synthesis. | Journal of pharmaceutical and biomedical analysis 20040310 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.