3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoic acid - CAS 1249919-66-1
Catalog: |
BB060873 |
Product Name: |
3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoic acid |
CAS: |
1249919-66-1 |
Synonyms: |
3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoic acid; 3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoicacid |
IUPAC Name: | 3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoic acid |
Description: | 3-hydroxy-3-(4-hydroxyphenyl)-2,2-dimethylpropanoic acid (cas# 1249919-66-1) is a useful research chemical. |
Molecular Weight: | 210.22 |
Molecular Formula: | C11H14O4 |
Canonical SMILES: | CC(C)(C(C1=CC=C(C=C1)O)O)C(=O)O |
InChI: | InChI=1S/C11H14O4/c1-11(2,10(14)15)9(13)7-3-5-8(12)6-4-7/h3-6,9,12-13H,1-2H3,(H,14,15) |
InChI Key: | FCRPIDBTONMRNW-UHFFFAOYSA-N |
Complexity: | 229 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.08920892 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.08920892 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 77.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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