(4-ethylthiophen-2-yl)-phenylmethanol

C13H14OS — CID 121226309

IUPAC(4-ethylthiophen-2-yl)-phenylmethanol
SMILESCCc1csc(C(O)c2ccccc2)c1
InChIInChI=1S/C13H14OS/c1-2-10-8-12(15-9-10)13(14)11-6-4-3-5-7-11/h3-9,13-14H,2H2,1H3
InChIKeyDRZJIGOVFANWTK-UHFFFAOYSA-N
MW218.32 g/mol
LogP3.39
Rot. Bonds3

About (4-ethylthiophen-2-yl)-phenylmethanol

(4-ethylthiophen-2-yl)-phenylmethanol (PubChem CID 121226309) has the molecular formula C13H14OS and a molecular weight of 218.32 g/mol. Its IUPAC name is (4-ethylthiophen-2-yl)-phenylmethanol.

Molecular Properties

Compound Name(4-ethylthiophen-2-yl)-phenylmethanol
PubChem CID121226309
Molecular FormulaC13H14OS
Molecular Weight218.32 g/mol
Exact Mass218.08
IUPAC Name(4-ethylthiophen-2-yl)-phenylmethanol
SMILESCCc1csc(C(O)c2ccccc2)c1
InChIInChI=1S/C13H14OS/c1-2-10-8-12(15-9-10)13(14)11-6-4-3-5-7-11/h3-9,13-14H,2H2,1H3
InChIKeyDRZJIGOVFANWTK-UHFFFAOYSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(3-bromophenyl)propyl]-4-ethylthiophene
CID 70892561
(4-ethylphenyl)-thiophen-2-ylmethanol
CID 61104575
(3-ethylphenyl)-(4-methyl-1,3-thiazol-2-yl)methanol
CID 104769434
(4-ethylphenyl)-(5-iodothiophen-3-yl)methanol
CID 79684538
(4-methyl-1,3-thiazol-2-yl)-phenylmethanol
CID 55201426
2-amino-2-(4-ethylthiophen-2-yl)acetonitrile
CID 131504622
(4-ethylthiophen-2-yl)-methyl-phenylsulfanium
CID 87458756
(4,5-dibromothiophen-2-yl)-(4-ethylphenyl)methanol
CID 80535254
1,1-diphenylhex-3-yn-2-ol
CID 172793556
(4-bromo-5-methylthiophen-2-yl)-(3-ethylphenyl)methanol
CID 102829560
(S)-[3-[(R)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542470
(S)-(5-ethyl-1,3,4-oxadiazol-2-yl)-phenylmethanol
CID 101417641

Frequently Asked Questions

What is the IUPAC name of (4-ethylthiophen-2-yl)-phenylmethanol?
The IUPAC name of (4-ethylthiophen-2-yl)-phenylmethanol (CID 121226309) is (4-ethylthiophen-2-yl)-phenylmethanol.
What is the SMILES notation for (4-ethylthiophen-2-yl)-phenylmethanol?
The canonical SMILES for (4-ethylthiophen-2-yl)-phenylmethanol is CCc1csc(C(O)c2ccccc2)c1.
What is the InChIKey of (4-ethylthiophen-2-yl)-phenylmethanol?
The InChIKey is DRZJIGOVFANWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14OS/c1-2-10-8-12(15-9-10)13(14)11-6-4-3-5-7-11/h3-9,13-14H,2H2,1H3.
What are the key properties of (4-ethylthiophen-2-yl)-phenylmethanol?
(4-ethylthiophen-2-yl)-phenylmethanol has a molecular weight of 218.32 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylthiophen-2-yl)-phenylmethanol is sourced from PubChem (CID 121226309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).