3-Chloro-5-(2-fluoro-3-methoxyphenyl)phenol - CAS 1261920-31-3
Catalog: |
BB069413 |
Product Name: |
3-Chloro-5-(2-fluoro-3-methoxyphenyl)phenol |
CAS: |
1261920-31-3 |
Synonyms: |
5-Chloro-2'-fluoro-3'-methoxy-[1,1'-biphenyl]-3-ol; 3-CHLORO-5-(2-FLUORO-3-METHOXYPHENYL)PHENOL; 5-Chloro-2'-fluoro-3'-methoxy[1,1'-biphenyl]-3-ol |
IUPAC Name: | 3-chloro-5-(2-fluoro-3-methoxyphenyl)phenol |
Description: | 3-Chloro-5-(2-fluoro-3-methoxyphenyl)phenol |
Molecular Weight: | 252.67 |
Molecular Formula: | C13H10ClFO2 |
Canonical SMILES: | COC1=CC=CC(=C1F)C2=CC(=CC(=C2)Cl)O |
InChI: | InChI=1S/C13H10ClFO2/c1-17-12-4-2-3-11(13(12)15)8-5-9(14)7-10(16)6-8/h2-7,16H,1H3 |
InChI Key: | ICUMVTUMOGNIIL-UHFFFAOYSA-N |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.0353354 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.0353354 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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