7-phenylmethoxy-8-prop-2-enyl-4H-chromene

C19H18O2 — CID 140967284

IUPAC7-phenylmethoxy-8-prop-2-enyl-4H-chromene
SMILESC=CCc1c(OCc2ccccc2)ccc2c1OC=CC2
InChIInChI=1S/C19H18O2/c1-2-7-17-18(21-14-15-8-4-3-5-9-15)12-11-16-10-6-13-20-19(16)17/h2-6,8-9,11-13H,1,7,10,14H2
InChIKeyPHODEQQWEPBQEX-UHFFFAOYSA-N
MW278.35 g/mol
LogP4.44
Rot. Bonds5

About 7-phenylmethoxy-8-prop-2-enyl-4H-chromene

7-phenylmethoxy-8-prop-2-enyl-4H-chromene (PubChem CID 140967284) has the molecular formula C19H18O2 and a molecular weight of 278.35 g/mol. Its IUPAC name is 7-phenylmethoxy-8-prop-2-enyl-4H-chromene.

Molecular Properties

Compound Name7-phenylmethoxy-8-prop-2-enyl-4H-chromene
PubChem CID140967284
Molecular FormulaC19H18O2
Molecular Weight278.35 g/mol
Exact Mass278.13
IUPAC Name7-phenylmethoxy-8-prop-2-enyl-4H-chromene
SMILESC=CCc1c(OCc2ccccc2)ccc2c1OC=CC2
InChIInChI=1S/C19H18O2/c1-2-7-17-18(21-14-15-8-4-3-5-9-15)12-11-16-10-6-13-20-19(16)17/h2-6,8-9,11-13H,1,7,10,14H2
InChIKeyPHODEQQWEPBQEX-UHFFFAOYSA-N
XLogP4.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-phenylmethoxy-2-prop-2-enylbenzaldehyde
CID 11357203
3-(cyclobutylmethyl)-8-phenylmethoxy-9-prop-2-enyl-1,2,5,9b-tetrahydrobenzo[e]indole
CID 23330791
5,7-bis(phenylmethoxy)-4H-chromene
CID 25232853
3-phenylmethoxy-4-prop-2-enylphenol
CID 174520142
(E)-3-(3-phenylmethoxy-2-prop-2-enylphenyl)prop-2-enenitrile
CID 18522243
1-methoxy-2-phenylmethoxy-4-(prop-2-enoxymethyl)-3-prop-2-enylbenzene
CID 23247258
5-phenylmethoxy-4-prop-2-enylbenzene-1,3-dicarboxylic acid
CID 11098989
2-phenylmethoxy-3-prop-2-enylbenzene-1,4-diamine
CID 163549085
4-methoxy-2-phenylmethoxy-1-prop-2-enylbenzene
CID 68966556
4-methoxy-3-phenylmethoxy-2-prop-2-enylbenzaldehyde
CID 15574386
4-phenylmethoxy-1-prop-2-enoxy-2-prop-2-enylbenzene
CID 22261130
4-phenylmethoxy-1H-indene
CID 118181545

Frequently Asked Questions

What is the IUPAC name of 7-phenylmethoxy-8-prop-2-enyl-4H-chromene?
The IUPAC name of 7-phenylmethoxy-8-prop-2-enyl-4H-chromene (CID 140967284) is 7-phenylmethoxy-8-prop-2-enyl-4H-chromene.
What is the SMILES notation for 7-phenylmethoxy-8-prop-2-enyl-4H-chromene?
The canonical SMILES for 7-phenylmethoxy-8-prop-2-enyl-4H-chromene is C=CCc1c(OCc2ccccc2)ccc2c1OC=CC2.
What is the InChIKey of 7-phenylmethoxy-8-prop-2-enyl-4H-chromene?
The InChIKey is PHODEQQWEPBQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O2/c1-2-7-17-18(21-14-15-8-4-3-5-9-15)12-11-16-10-6-13-20-19(16)17/h2-6,8-9,11-13H,1,7,10,14H2.
What are the key properties of 7-phenylmethoxy-8-prop-2-enyl-4H-chromene?
7-phenylmethoxy-8-prop-2-enyl-4H-chromene has a molecular weight of 278.35 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxy-8-prop-2-enyl-4H-chromene is sourced from PubChem (CID 140967284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).