[2-hydroxy-6-(hydroxymethyl)phenyl]azanium

C7H10NO2+ — CID 163514906

IUPAC[2-hydroxy-6-(hydroxymethyl)phenyl]azanium
SMILES[NH3+]c1c(O)cccc1CO
InChIInChI=1S/C7H9NO2/c8-7-5(4-9)2-1-3-6(7)10/h1-3,9-10H,4,8H2/p+1
InChIKeyDFWBMEJBHIZHNR-UHFFFAOYSA-O
MW140.16 g/mol
LogP-0.24
Rot. Bonds1

About [2-hydroxy-6-(hydroxymethyl)phenyl]azanium

[2-hydroxy-6-(hydroxymethyl)phenyl]azanium (PubChem CID 163514906) has the molecular formula C7H10NO2+ and a molecular weight of 140.16 g/mol. Its IUPAC name is [2-hydroxy-6-(hydroxymethyl)phenyl]azanium.

Molecular Properties

Compound Name[2-hydroxy-6-(hydroxymethyl)phenyl]azanium
PubChem CID163514906
Molecular FormulaC7H10NO2+
Molecular Weight140.16 g/mol
Exact Mass140.07
IUPAC Name[2-hydroxy-6-(hydroxymethyl)phenyl]azanium
SMILES[NH3+]c1c(O)cccc1CO
InChIInChI=1S/C7H9NO2/c8-7-5(4-9)2-1-3-6(7)10/h1-3,9-10H,4,8H2/p+1
InChIKeyDFWBMEJBHIZHNR-UHFFFAOYSA-O
XLogP-0.24
TPSA68.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(hydroxymethyl)phenol;methane
CID 157439231
CID 137424646
CID 137424646
calcium;hydride;2-(hydroxymethyl)phenol
CID 173090882
cyclohexane;2-(hydroxymethyl)phenol
CID 174697635
formaldehyde;2-(hydroxymethyl)phenol
CID 69155710
[2-(hydroxymethyl)phenyl]methanol;methane
CID 143282166
2-[[2-(hydroxymethyl)anilino]methyl]phenol
CID 43743175
4,6-bis(hydroxymethyl)benzene-1,3-diol
CID 66920860
2-(2-hydroxyethyl)-6-(hydroxymethyl)phenol
CID 117276602
3-[[2-(hydroxymethyl)anilino]methyl]benzene-1,2-diol
CID 61318684
2-[amino(cyclopropyl)methyl]-3-(hydroxymethyl)phenol
CID 130042224
2-(hydroxymethyl)phenol;pentane
CID 70619203

Frequently Asked Questions

What is the IUPAC name of [2-hydroxy-6-(hydroxymethyl)phenyl]azanium?
The IUPAC name of [2-hydroxy-6-(hydroxymethyl)phenyl]azanium (CID 163514906) is [2-hydroxy-6-(hydroxymethyl)phenyl]azanium.
What is the SMILES notation for [2-hydroxy-6-(hydroxymethyl)phenyl]azanium?
The canonical SMILES for [2-hydroxy-6-(hydroxymethyl)phenyl]azanium is [NH3+]c1c(O)cccc1CO.
What is the InChIKey of [2-hydroxy-6-(hydroxymethyl)phenyl]azanium?
The InChIKey is DFWBMEJBHIZHNR-UHFFFAOYSA-O. The full InChI is InChI=1S/C7H9NO2/c8-7-5(4-9)2-1-3-6(7)10/h1-3,9-10H,4,8H2/p+1.
What are the key properties of [2-hydroxy-6-(hydroxymethyl)phenyl]azanium?
[2-hydroxy-6-(hydroxymethyl)phenyl]azanium has a molecular weight of 140.16 g/mol, XLogP of -0.24, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-hydroxy-6-(hydroxymethyl)phenyl]azanium is sourced from PubChem (CID 163514906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).