[3-(2H-tetrazol-5-yl)phenyl]methanol

C8H8N4O — CID 23437784

IUPAC[3-(2H-tetrazol-5-yl)phenyl]methanol
SMILESOCc1cccc(-c2nn[nH]n2)c1
InChIInChI=1S/C8H8N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12)
InChIKeyYGESRLFHDANLIL-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.36
Rot. Bonds2

About [3-(2H-tetrazol-5-yl)phenyl]methanol

[3-(2H-tetrazol-5-yl)phenyl]methanol (PubChem CID 23437784) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is [3-(2H-tetrazol-5-yl)phenyl]methanol.

Molecular Properties

Compound Name[3-(2H-tetrazol-5-yl)phenyl]methanol
PubChem CID23437784
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name[3-(2H-tetrazol-5-yl)phenyl]methanol
SMILESOCc1cccc(-c2nn[nH]n2)c1
InChIInChI=1S/C8H8N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12)
InChIKeyYGESRLFHDANLIL-UHFFFAOYSA-N
XLogP0.36
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2'-(1H-Tetrazol-5-yl)biphenyl-4-yl)methanol
CID 11507097
1-[4-fluoro-2-(2H-tetrazol-5-yl)phenyl]pentan-1-ol
CID 155675476
4-(1H-Tetrazol-5-YL)benzyl alcohol
CID 22633334
(Z)-4-hydroxy-2-oxo-4-[3-(2H-tetrazol-5-yl)phenyl]but-3-enoic acid
CID 56589591
1-[2-(2H-tetrazol-5-yl)phenyl]pentan-1-ol
CID 155675457
1-[2-(2H-tetrazol-5-yl)phenyl]butan-1-ol
CID 155675470
1-[2-(2H-tetrazol-5-yl)phenyl]hexan-1-ol
CID 155675478
1-[4-(cyclohexen-1-yl)-2-(2H-tetrazol-5-yl)phenyl]butan-1-ol
CID 177643783
1-[2-(2H-tetrazol-5-yl)phenyl]ethanol
CID 14983929
[3-[2-(4-fluorophenyl)-3-[3-(2H-tetrazol-5-yl)phenyl]propyl]phenyl]methanol
CID 57117246
[4-[2-(4-fluorophenyl)-3-[3-(2H-tetrazol-5-yl)phenyl]propyl]phenyl]methanol
CID 57247715
[3-[1-(4-fluorophenyl)-3-[3-(2H-tetrazol-5-yl)phenyl]propan-2-yl]phenyl]methanol
CID 57298885

Frequently Asked Questions

What is the IUPAC name of [3-(2H-tetrazol-5-yl)phenyl]methanol?
The IUPAC name of [3-(2H-tetrazol-5-yl)phenyl]methanol (CID 23437784) is [3-(2H-tetrazol-5-yl)phenyl]methanol.
What is the SMILES notation for [3-(2H-tetrazol-5-yl)phenyl]methanol?
The canonical SMILES for [3-(2H-tetrazol-5-yl)phenyl]methanol is OCc1cccc(-c2nn[nH]n2)c1.
What is the InChIKey of [3-(2H-tetrazol-5-yl)phenyl]methanol?
The InChIKey is YGESRLFHDANLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c13-5-6-2-1-3-7(4-6)8-9-11-12-10-8/h1-4,13H,5H2,(H,9,10,11,12).
What are the key properties of [3-(2H-tetrazol-5-yl)phenyl]methanol?
[3-(2H-tetrazol-5-yl)phenyl]methanol has a molecular weight of 176.18 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2H-tetrazol-5-yl)phenyl]methanol is sourced from PubChem (CID 23437784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).