(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid

C10H10O4 — CID 15965811

IUPAC(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid
SMILESCO/C(=C\c1ccc(O)cc1)C(=O)O
InChIInChI=1S/C10H10O4/c1-14-9(10(12)13)6-7-2-4-8(11)5-3-7/h2-6,11H,1H3,(H,12,13)/b9-6-
InChIKeyHUSAJBFJIABSAO-TWGQIWQCSA-N
MW194.19 g/mol
LogP1.46
Rot. Bonds3

About (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid

(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid (PubChem CID 15965811) has the molecular formula C10H10O4 and a molecular weight of 194.19 g/mol. Its IUPAC name is (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid.

Molecular Properties

Compound Name(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid
PubChem CID15965811
Molecular FormulaC10H10O4
Molecular Weight194.19 g/mol
Exact Mass194.06
IUPAC Name(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid
SMILESCO/C(=C\c1ccc(O)cc1)C(=O)O
InChIInChI=1S/C10H10O4/c1-14-9(10(12)13)6-7-2-4-8(11)5-3-7/h2-6,11H,1H3,(H,12,13)/b9-6-
InChIKeyHUSAJBFJIABSAO-TWGQIWQCSA-N
XLogP1.46
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

ethanamine;(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid
CID 173177600
N,N-diethylethanamine;(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid
CID 173177567
2-methoxy-3-phenylprop-2-enoic acid
CID 7021154
CID 159805914
CID 159805914
europium;tris(2-methoxy-3-phenylprop-2-enoic acid)
CID 169448208
strontium bis(4-[(Z)-2-carboxy-2-methoxyethenyl]phenolate)
CID 87864699
azane;(Z)-2-methoxy-3-(4-phenylmethoxyphenyl)prop-2-enoic acid
CID 173177562
methanamine;2-methoxy-3-(4-phenylmethoxyphenyl)prop-2-enoic acid
CID 173177580
2-[(4-hydroxyphenyl)methylidene]propanedioic acid
CID 519420
ethanamine;(Z)-2-methoxy-3-(4-phenylmethoxyphenyl)prop-2-enoic acid
CID 173177701
(Z)-2-methoxy-3-[4-[3-(methylamino)phenyl]phenyl]prop-2-enoic acid
CID 68961559
(Z)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxyphenyl)-2-methoxyprop-2-enamide
CID 46232496

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid?
The IUPAC name of (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid (CID 15965811) is (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid.
What is the SMILES notation for (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid?
The canonical SMILES for (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid is CO/C(=C\c1ccc(O)cc1)C(=O)O.
What is the InChIKey of (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid?
The InChIKey is HUSAJBFJIABSAO-TWGQIWQCSA-N. The full InChI is InChI=1S/C10H10O4/c1-14-9(10(12)13)6-7-2-4-8(11)5-3-7/h2-6,11H,1H3,(H,12,13)/b9-6-.
What are the key properties of (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid?
(Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid has a molecular weight of 194.19 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(4-hydroxyphenyl)-2-methoxyprop-2-enoic acid is sourced from PubChem (CID 15965811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).