3-(3-Hydroxyphenyl)butanoic Acid - CAS 51038-69-8
Catalog: |
BB027304 |
Product Name: |
3-(3-Hydroxyphenyl)butanoic Acid |
CAS: |
51038-69-8 |
Synonyms: |
3-(3-hydroxyphenyl)butanoic acid; 3-(3-hydroxyphenyl)butanoic acid |
IUPAC Name: | 3-(3-hydroxyphenyl)butanoic acid |
Description: | 3-(3-Hydroxyphenyl)butanoic Acid (CAS# 51038-69-8 ) is a useful research chemical. |
Molecular Weight: | 180.20 |
Molecular Formula: | C10H12O3 |
Canonical SMILES: | CC(CC(=O)O)C1=CC(=CC=C1)O |
InChI: | InChI=1S/C10H12O3/c1-7(5-10(12)13)8-3-2-4-9(11)6-8/h2-4,6-7,11H,5H2,1H3,(H,12,13) |
InChI Key: | ZHKGOQQJCBDHFY-UHFFFAOYSA-N |
LogP: | 1.97040 |
Publication Number | Title | Priority Date |
JP-3451673-B2 | Ink composition for moisture indicator and recording medium using the same | 19931025 |
JP-H07120398-A | Ink composition for moisture indicator and recording medium using the same | 19931025 |
US-3758562-A | Hydroxylation of aromatic acids | 19690929 |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.078644241 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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