2-(3-Ethylphenyl)acetic Acid - CAS 89723-25-1
Catalog: |
BB065495 |
Product Name: |
2-(3-Ethylphenyl)acetic Acid |
CAS: |
89723-25-1 |
Synonyms: |
2-(3-ETHYLPHENYL)ACETIC ACID; 2-(3-ETHYLPHENYL)ACETICACID |
IUPAC Name: | 2-(3-ethylphenyl)acetic acid |
Molecular Weight: | 164.2 |
Molecular Formula: | C10H12O2 |
Canonical SMILES: | CCC1=CC(=CC=C1)CC(=O)O |
InChI: | InChI=1S/C10H12O2/c1-2-8-4-3-5-9(6-8)7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12) |
InChI Key: | GJMPAFQIQOEENG-UHFFFAOYSA-N |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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