5-[2-(Trifluoromethyl)phenyl]-1H-pyrrole-3-methanol - CAS 881674-62-0
Catalog: |
BB038767 |
Product Name: |
5-[2-(Trifluoromethyl)phenyl]-1H-pyrrole-3-methanol |
CAS: |
881674-62-0 |
Synonyms: |
[5-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]methanol; [5-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]methanol |
IUPAC Name: | [5-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl]methanol |
Description: | 5-[2-(Trifluoromethyl)phenyl]-1H-pyrrole-3-methanol (CAS# 881674-62-0 ) is a useful research chemical. |
Molecular Weight: | 241.21 |
Molecular Formula: | C12H10F3NO |
Canonical SMILES: | C1=CC=C(C(=C1)C2=CC(=CN2)CO)C(F)(F)F |
InChI: | InChI=1S/C12H10F3NO/c13-12(14,15)10-4-2-1-3-9(10)11-5-8(7-17)6-16-11/h1-6,16-17H,7H2 |
InChI Key: | POEJSRFJNSUDHP-UHFFFAOYSA-N |
LogP: | 3.19280 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.07144843 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.07144843 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 36 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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