[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene

C19H21FO — CID 177392897

IUPAC[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene
SMILESCOC(CCc1ccccc1)/C(F)=C/Cc1ccccc1
InChIInChI=1S/C19H21FO/c1-21-19(15-13-17-10-6-3-7-11-17)18(20)14-12-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3/b18-14-
InChIKeyAINFEJQRHQTCJW-JXAWBTAJSA-N
MW284.37 g/mol
LogP4.73
Rot. Bonds7

About [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene

[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene (PubChem CID 177392897) has the molecular formula C19H21FO and a molecular weight of 284.37 g/mol. Its IUPAC name is [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene.

Molecular Properties

Compound Name[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene
PubChem CID177392897
Molecular FormulaC19H21FO
Molecular Weight284.37 g/mol
Exact Mass284.16
IUPAC Name[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene
SMILESCOC(CCc1ccccc1)/C(F)=C/Cc1ccccc1
InChIInChI=1S/C19H21FO/c1-21-19(15-13-17-10-6-3-7-11-17)18(20)14-12-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3/b18-14-
InChIKeyAINFEJQRHQTCJW-JXAWBTAJSA-N
XLogP4.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Bis(1-phenylethyl) ether
CID 62342
Benzene, [2-(cyclohexyloxy)ethyl]-
CID 166527
2H-Pyran, 3,6-dihydro-4-methyl-2-phenyl-
CID 108443
Benzene, 1,1'-(methoxymethylene)bis-
CID 219159
2H-Pyran, 3,6-dihydro-2,4-dimethyl-6-phenyl-
CID 107069
2H-Pyran, 3,6-dihydro-4,6-dimethyl-2-phenyl-
CID 107070
(4E,6E)-1,7-diphenylhepta-4,6-dien-3-ol
CID 13347322
(1-Methoxyethyl)benzene
CID 19913
Benzyl 2-phenylethyl ether
CID 108637
Benzene, [2-[(3-methyl-2-buten-1-yl)oxy]ethyl]-
CID 162597
3,6-Dihydro-4,6-dimethyl-2-(1-phenylethyl)-2H-pyran
CID 122420336
Furan, 2,5-diphenyl-tetrahydro-
CID 576417

Frequently Asked Questions

What is the IUPAC name of [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene?
The IUPAC name of [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene (CID 177392897) is [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene.
What is the SMILES notation for [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene?
The canonical SMILES for [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene is COC(CCc1ccccc1)/C(F)=C/Cc1ccccc1.
What is the InChIKey of [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene?
The InChIKey is AINFEJQRHQTCJW-JXAWBTAJSA-N. The full InChI is InChI=1S/C19H21FO/c1-21-19(15-13-17-10-6-3-7-11-17)18(20)14-12-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3/b18-14-.
What are the key properties of [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene?
[(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene has a molecular weight of 284.37 g/mol, XLogP of 4.73, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3-fluoro-4-methoxy-6-phenylhex-2-enyl]benzene is sourced from PubChem (CID 177392897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).