2-Ethyl-4-fluorophenol - CAS 398-71-0
Catalog: |
BB024168 |
Product Name: |
2-Ethyl-4-fluorophenol |
CAS: |
398-71-0 |
Synonyms: |
2-ethyl-4-fluorophenol |
IUPAC Name: | 2-ethyl-4-fluorophenol |
Description: | 2-Ethyl-4-fluorophenol (CAS# 398-71-0) is a useful research chemical. |
Molecular Weight: | 140.15 |
Molecular Formula: | C8H9FO |
Canonical SMILES: | CCC1=C(C=CC(=C1)F)O |
InChI: | InChI=1S/C8H9FO/c1-2-6-5-7(9)3-4-8(6)10/h3-5,10H,2H2,1H3 |
InChI Key: | JKZWRPGOAAMNQY-UHFFFAOYSA-N |
Boiling Point: | 162 ℃ |
Density: | 1.122 g/cm3 |
MDL: | MFCD00067856 |
LogP: | 2.09370 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 |
Signal Word: | Danger |
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Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.063743068 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.063743068 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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