2-(2-hydroxyphenyl)ethyl methyl carbonate

C10H12O4 — CID 102381478

IUPAC2-(2-hydroxyphenyl)ethyl methyl carbonate
SMILESCOC(=O)OCCc1ccccc1O
InChIInChI=1S/C10H12O4/c1-13-10(12)14-7-6-8-4-2-3-5-9(8)11/h2-5,11H,6-7H2,1H3
InChIKeyMLAYJMPULUOUKT-UHFFFAOYSA-N
MW196.20 g/mol
LogP1.72
Rot. Bonds3

About 2-(2-hydroxyphenyl)ethyl methyl carbonate

2-(2-hydroxyphenyl)ethyl methyl carbonate (PubChem CID 102381478) has the molecular formula C10H12O4 and a molecular weight of 196.20 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)ethyl methyl carbonate.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)ethyl methyl carbonate
PubChem CID102381478
Molecular FormulaC10H12O4
Molecular Weight196.20 g/mol
Exact Mass196.07
IUPAC Name2-(2-hydroxyphenyl)ethyl methyl carbonate
SMILESCOC(=O)OCCc1ccccc1O
InChIInChI=1S/C10H12O4/c1-13-10(12)14-7-6-8-4-2-3-5-9(8)11/h2-5,11H,6-7H2,1H3
InChIKeyMLAYJMPULUOUKT-UHFFFAOYSA-N
XLogP1.72
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(E)-5-(2-hydroxyphenyl)pent-2-enyl] methyl carbonate
CID 101015605
2-amino-N-[2-(2-hydroxyphenyl)ethyl]-3-methoxypropanamide;hydrochloride
CID 120986590
3-(2-hydroxyphenyl)-N-(2-methoxyethoxy)propanamide
CID 79675926
2-[2-(methylaminooxy)ethyl]phenol
CID 105433402
methyl 2-[3-(2-hydroxyphenyl)propanoylamino]propanoate
CID 60712354
methyl (2S)-2-[(2-hydroxyphenyl)methylamino]propanoate
CID 43723616
(2R)-2-amino-N-[2-(2-hydroxyphenyl)ethyl]propanamide
CID 120872754
bis[2-(2-tert-butylphenyl)ethyl] carbonate
CID 67162129
2-[(2-hydroxyphenyl)methylamino]-3-methoxypropanamide
CID 115774727
2-(2-hydroxyphenyl)-N-(2-methoxyethoxy)acetamide
CID 79679652
methyl 4-(2-hydroxyphenyl)-2,2-dimethylbutanoate
CID 146319114
methyl 3-[(2-hydroxyphenyl)methylamino]-2-methylpropanoate
CID 114332021

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)ethyl methyl carbonate?
The IUPAC name of 2-(2-hydroxyphenyl)ethyl methyl carbonate (CID 102381478) is 2-(2-hydroxyphenyl)ethyl methyl carbonate.
What is the SMILES notation for 2-(2-hydroxyphenyl)ethyl methyl carbonate?
The canonical SMILES for 2-(2-hydroxyphenyl)ethyl methyl carbonate is COC(=O)OCCc1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenyl)ethyl methyl carbonate?
The InChIKey is MLAYJMPULUOUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O4/c1-13-10(12)14-7-6-8-4-2-3-5-9(8)11/h2-5,11H,6-7H2,1H3.
What are the key properties of 2-(2-hydroxyphenyl)ethyl methyl carbonate?
2-(2-hydroxyphenyl)ethyl methyl carbonate has a molecular weight of 196.20 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)ethyl methyl carbonate is sourced from PubChem (CID 102381478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).