(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate

C19H14O4 — CID 135397828

IUPAC(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate
SMILESC=CC(=O)Oc1ccc2c(c1OC(=O)C=C)Cc1ccccc1-2
InChIInChI=1S/C19H14O4/c1-3-17(20)22-16-10-9-14-13-8-6-5-7-12(13)11-15(14)19(16)23-18(21)4-2/h3-10H,1-2,11H2
InChIKeyOWYWOEQQKSZEIR-UHFFFAOYSA-N
MW306.32 g/mol
LogP3.44
Rot. Bonds4

About (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate

(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate (PubChem CID 135397828) has the molecular formula C19H14O4 and a molecular weight of 306.32 g/mol. Its IUPAC name is (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate.

Molecular Properties

Compound Name(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate
PubChem CID135397828
Molecular FormulaC19H14O4
Molecular Weight306.32 g/mol
Exact Mass306.09
IUPAC Name(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate
SMILESC=CC(=O)Oc1ccc2c(c1OC(=O)C=C)Cc1ccccc1-2
InChIInChI=1S/C19H14O4/c1-3-17(20)22-16-10-9-14-13-8-6-5-7-12(13)11-15(14)19(16)23-18(21)4-2/h3-10H,1-2,11H2
InChIKeyOWYWOEQQKSZEIR-UHFFFAOYSA-N
XLogP3.44
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate?
The IUPAC name of (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate (CID 135397828) is (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate.
What is the SMILES notation for (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate?
The canonical SMILES for (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate is C=CC(=O)Oc1ccc2c(c1OC(=O)C=C)Cc1ccccc1-2.
What is the InChIKey of (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate?
The InChIKey is OWYWOEQQKSZEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O4/c1-3-17(20)22-16-10-9-14-13-8-6-5-7-12(13)11-15(14)19(16)23-18(21)4-2/h3-10H,1-2,11H2.
What are the key properties of (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate?
(1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate has a molecular weight of 306.32 g/mol, XLogP of 3.44, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-prop-2-enoyloxy-9H-fluoren-2-yl) prop-2-enoate is sourced from PubChem (CID 135397828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).