ethene;2-hydroxybenzaldehyde

C9H10O2 — CID 23043417

IUPACethene;2-hydroxybenzaldehyde
SMILESC=C.O=Cc1ccccc1O
InChIInChI=1S/C7H6O2.C2H4/c8-5-6-3-1-2-4-7(6)9;1-2/h1-5,9H;1-2H2
InChIKeySXFAOOJYILDECN-UHFFFAOYSA-N
MW150.18 g/mol
LogP2.01
Rot. Bonds1

About ethene;2-hydroxybenzaldehyde

ethene;2-hydroxybenzaldehyde (PubChem CID 23043417) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is ethene;2-hydroxybenzaldehyde.

Molecular Properties

Compound Nameethene;2-hydroxybenzaldehyde
PubChem CID23043417
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Nameethene;2-hydroxybenzaldehyde
SMILESC=C.O=Cc1ccccc1O
InChIInChI=1S/C7H6O2.C2H4/c8-5-6-3-1-2-4-7(6)9;1-2/h1-5,9H;1-2H2
InChIKeySXFAOOJYILDECN-UHFFFAOYSA-N
XLogP2.01
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

CID 158421076
CID 158421076
2-hydroxybenzaldehyde;nickel(2+)
CID 18320961
sodium;hydride;2-hydroxybenzaldehyde
CID 173406661
2-hydroxybenzaldehyde;methanamine
CID 174602056
benzene-1,2-diamine;bis(2-hydroxybenzaldehyde)
CID 87647711
benzene-1,2-diamine;2-hydroxybenzaldehyde
CID 22463498
disodium;2-hydroxybenzaldehyde;sulfite
CID 21115552
aniline;2-hydroxybenzaldehyde
CID 159847329
copper;ethane-1,2-diamine;2-hydroxybenzaldehyde
CID 175387187
2-(2-hydroxyphenyl)benzaldehyde
CID 15593934
2-hydroxybenzaldehyde;3-hydroxybenzaldehyde
CID 19855746
bis(2-ethyl-2-(hydroxymethyl)propane-1,3-diol);2-hydroxybenzaldehyde
CID 175183399

Frequently Asked Questions

What is the IUPAC name of ethene;2-hydroxybenzaldehyde?
The IUPAC name of ethene;2-hydroxybenzaldehyde (CID 23043417) is ethene;2-hydroxybenzaldehyde.
What is the SMILES notation for ethene;2-hydroxybenzaldehyde?
The canonical SMILES for ethene;2-hydroxybenzaldehyde is C=C.O=Cc1ccccc1O.
What is the InChIKey of ethene;2-hydroxybenzaldehyde?
The InChIKey is SXFAOOJYILDECN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O2.C2H4/c8-5-6-3-1-2-4-7(6)9;1-2/h1-5,9H;1-2H2.
What are the key properties of ethene;2-hydroxybenzaldehyde?
ethene;2-hydroxybenzaldehyde has a molecular weight of 150.18 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-hydroxybenzaldehyde is sourced from PubChem (CID 23043417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).