(4-methoxyphenyl)methyl silylformate

C9H12O3Si — CID 123289214

IUPAC(4-methoxyphenyl)methyl silylformate
SMILESCOc1ccc(COC(=O)[SiH3])cc1
InChIInChI=1S/C9H12O3Si/c1-11-8-4-2-7(3-5-8)6-12-9(10)13/h2-5H,6H2,1,13H3
InChIKeyDOHDLYRFEWDCTJ-UHFFFAOYSA-N
MW196.28 g/mol
LogP0.70
Rot. Bonds3

About (4-methoxyphenyl)methyl silylformate

(4-methoxyphenyl)methyl silylformate (PubChem CID 123289214) has the molecular formula C9H12O3Si and a molecular weight of 196.28 g/mol. Its IUPAC name is (4-methoxyphenyl)methyl silylformate.

Molecular Properties

Compound Name(4-methoxyphenyl)methyl silylformate
PubChem CID123289214
Molecular FormulaC9H12O3Si
Molecular Weight196.28 g/mol
Exact Mass196.06
IUPAC Name(4-methoxyphenyl)methyl silylformate
SMILESCOc1ccc(COC(=O)[SiH3])cc1
InChIInChI=1S/C9H12O3Si/c1-11-8-4-2-7(3-5-8)6-12-9(10)13/h2-5H,6H2,1,13H3
InChIKeyDOHDLYRFEWDCTJ-UHFFFAOYSA-N
XLogP0.70
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.28
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-methoxyphenyl)methoxymethanethioic S-acid
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(4-methoxyphenyl)methyl 2-bromoacetate
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(4-methoxyphenyl)methyl 2,2-difluoro-2-sulfanylacetate
CID 163433987
(4-methoxyphenyl)methyl phenyl carbonate
CID 3084543
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CID 61304700
(4-methoxyphenyl)methyl 2-amino-3-sulfanylpropanoate
CID 61304102
1-[[(E)-but-2-en-2-yl]oxymethyl]-4-methoxybenzene
CID 145479406
(4-methoxyphenyl)methyl 2-(aminomethyl)-3-methylbutanoate
CID 65217996
[4-[(4-methoxyphenyl)diazenyl]phenyl]methyl carbonochloridate
CID 87506222
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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)methyl silylformate?
The IUPAC name of (4-methoxyphenyl)methyl silylformate (CID 123289214) is (4-methoxyphenyl)methyl silylformate.
What is the SMILES notation for (4-methoxyphenyl)methyl silylformate?
The canonical SMILES for (4-methoxyphenyl)methyl silylformate is COc1ccc(COC(=O)[SiH3])cc1.
What is the InChIKey of (4-methoxyphenyl)methyl silylformate?
The InChIKey is DOHDLYRFEWDCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O3Si/c1-11-8-4-2-7(3-5-8)6-12-9(10)13/h2-5H,6H2,1,13H3.
What are the key properties of (4-methoxyphenyl)methyl silylformate?
(4-methoxyphenyl)methyl silylformate has a molecular weight of 196.28 g/mol, XLogP of 0.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)methyl silylformate is sourced from PubChem (CID 123289214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).