2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol

C15H20O4 — CID 174569324

IUPAC2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol
SMILESC=C(C)C(=O)OCCO.C=CCc1ccccc1O
InChIInChI=1S/C9H10O.C6H10O3/c1-2-5-8-6-3-4-7-9(8)10;1-5(2)6(8)9-4-3-7/h2-4,6-7,10H,1,5H2;7H,1,3-4H2,2H3
InChIKeyGTUXZIWWWZLRPJ-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.22
Rot. Bonds5

About 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol

2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol (PubChem CID 174569324) has the molecular formula C15H20O4 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol.

Molecular Properties

Compound Name2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol
PubChem CID174569324
Molecular FormulaC15H20O4
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Name2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol
SMILESC=C(C)C(=O)OCCO.C=CCc1ccccc1O
InChIInChI=1S/C9H10O.C6H10O3/c1-2-5-8-6-3-4-7-9(8)10;1-5(2)6(8)9-4-3-7/h2-4,6-7,10H,1,5H2;7H,1,3-4H2,2H3
InChIKeyGTUXZIWWWZLRPJ-UHFFFAOYSA-N
XLogP2.22
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-methylprop-2-enoic acid;2-prop-2-enylphenol
CID 70155060
acetyl 2-hydroxybenzoate;2-hydroxyethyl 2-methylprop-2-enoate
CID 158691957
2-hydroxyethyl 2-methylprop-2-enoate;octakis(prop-1-ene)
CID 173395322
benzoic acid;2-hydroxyethyl 2-methylprop-2-enoate
CID 160874005
2-hydroxyethyl 2-methylprop-2-enoate;phenylmethoxymethylbenzene
CID 70268341
2-hydroxyethyl 2-methylprop-2-enoate;prop-2-enyl acetate
CID 175328029
3-[(2-hydroxyphenyl)methylamino]propyl 2-methylprop-2-enoate
CID 69343341
2-buta-1,3-dien-2-yloxyethanol;2-hydroxyethyl 2-methylprop-2-enoate
CID 163613282
4-hydroxybutyl 2-methylprop-2-enoate;2-hydroxyethyl 2-methylprop-2-enoate
CID 87803089
2-hydroxyethyl 2-methylprop-2-enoate;phosphorous acid
CID 162067648
boric acid;2-prop-2-enylphenol
CID 70457137
ethylbenzene;2-hydroxyethyl prop-2-enoate;propyl 2-methylprop-2-enoate
CID 123212080

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol?
The IUPAC name of 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol (CID 174569324) is 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol.
What is the SMILES notation for 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol?
The canonical SMILES for 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol is C=C(C)C(=O)OCCO.C=CCc1ccccc1O.
What is the InChIKey of 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol?
The InChIKey is GTUXZIWWWZLRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O.C6H10O3/c1-2-5-8-6-3-4-7-9(8)10;1-5(2)6(8)9-4-3-7/h2-4,6-7,10H,1,5H2;7H,1,3-4H2,2H3.
What are the key properties of 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol?
2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol has a molecular weight of 264.32 g/mol, XLogP of 2.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl 2-methylprop-2-enoate;2-prop-2-enylphenol is sourced from PubChem (CID 174569324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).