(1-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrrol-2-yl)methanol

HCID 90404801

Notes Reactions

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Basic information

Standard SMILES: OCc1c(C(F)(F)F)ccn1-c1ccc(Cl)cc1
InChIKey: LROKALIKJNERAS-UHFFFAOYSA-N
Molecular formula: C12H9ClF3NO
Average molar mass: 275.65 g/mol

Names & identifiers

Preferred name: (1-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrrol-2-yl)methanol
IUPAC: [1-(4-chlorophenyl)-3-(trifluoromethyl)pyrrol-2-yl]methanol

Names & synonyms

(1-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrrol-2-yl)methanol[1-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrrol-2-yl]methanolSCHEMBL16030876

Database identifiers

PubChem CID: 90404801

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 25.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 279

Related reactions

12 records

New reaction record

HRID 1404161As productuspto-grants-2014_12

HRID 1404162As reactantuspto-grants-2014_12

HRID 1404164As reactantuspto-grants-2014_12

HRID 1404165As reactantuspto-grants-2014_12

HRID 1404183As productuspto-grants-2014_12

HRID 1404184As reactantuspto-grants-2014_12

HRID 2167368As productuspto-grants-2015_06

HRID 2167369As reactantuspto-grants-2015_06

Compound notes

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