1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene

C10H11O2P — CID 139647655

IUPAC1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene
SMILESCOc1cccc(CC=CP=O)c1
InChIInChI=1S/C10H11O2P/c1-12-10-6-2-4-9(8-10)5-3-7-13-11/h2-4,6-8H,5H2,1H3
InChIKeyAOXPCKAQRVNNFI-UHFFFAOYSA-N
MW194.17 g/mol
LogP3.04
Rot. Bonds4

About 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene

1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene (PubChem CID 139647655) has the molecular formula C10H11O2P and a molecular weight of 194.17 g/mol. Its IUPAC name is 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene.

Molecular Properties

Compound Name1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene
PubChem CID139647655
Molecular FormulaC10H11O2P
Molecular Weight194.17 g/mol
Exact Mass194.05
IUPAC Name1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene
SMILESCOc1cccc(CC=CP=O)c1
InChIInChI=1S/C10H11O2P/c1-12-10-6-2-4-9(8-10)5-3-7-13-11/h2-4,6-8H,5H2,1H3
InChIKeyAOXPCKAQRVNNFI-UHFFFAOYSA-N
XLogP3.04
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.17
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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(E)-5-(3-methoxyphenyl)-3-methylpent-3-enal
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(3-methoxyphenyl)methanethiol
CID 10749403
(3-methoxyphenyl)(113C)methanol
CID 11593446
1-ethyl-3-methoxybenzene;hydrofluoride
CID 174493623
1-[(Z)-4-(3-methoxyphenyl)but-2-enyl]piperazine
CID 117269337
1-methoxy-3-[(3-methoxyphenyl)methylsulfonylmethyl]benzene
CID 20702839
1-[(E)-but-2-enyl]-3-phenoxybenzene
CID 23463492
1-methoxy-3-propylbenzene
CID 14270128
fluoro hydrogen sulfate;1-methoxy-3-prop-2-enylbenzene
CID 175557929
4-(3-methoxyphenyl)butanal
CID 10821200
1-but-2-enyl-3-[(2-methylpropan-2-yl)oxy]benzene
CID 54025707

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene?
The IUPAC name of 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene (CID 139647655) is 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene.
What is the SMILES notation for 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene?
The canonical SMILES for 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene is COc1cccc(CC=CP=O)c1.
What is the InChIKey of 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene?
The InChIKey is AOXPCKAQRVNNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11O2P/c1-12-10-6-2-4-9(8-10)5-3-7-13-11/h2-4,6-8H,5H2,1H3.
What are the key properties of 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene?
1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene has a molecular weight of 194.17 g/mol, XLogP of 3.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(3-phosphorosoprop-2-enyl)benzene is sourced from PubChem (CID 139647655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).