methyl acetate;1-methyl-1-phenylhydrazine

C10H16N2O2 — CID 90706381

IUPACmethyl acetate;1-methyl-1-phenylhydrazine
SMILESCN(N)c1ccccc1.COC(C)=O
InChIInChI=1S/C7H10N2.C3H6O2/c1-9(8)7-5-3-2-4-6-7;1-3(4)5-2/h2-6H,8H2,1H3;1-2H3
InChIKeyCHWMUUBPFHQWTN-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.18
Rot. Bonds1

About methyl acetate;1-methyl-1-phenylhydrazine

methyl acetate;1-methyl-1-phenylhydrazine (PubChem CID 90706381) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is methyl acetate;1-methyl-1-phenylhydrazine.

Molecular Properties

Compound Namemethyl acetate;1-methyl-1-phenylhydrazine
PubChem CID90706381
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Namemethyl acetate;1-methyl-1-phenylhydrazine
SMILESCN(N)c1ccccc1.COC(C)=O
InChIInChI=1S/C7H10N2.C3H6O2/c1-9(8)7-5-3-2-4-6-7;1-3(4)5-2/h2-6H,8H2,1H3;1-2H3
InChIKeyCHWMUUBPFHQWTN-UHFFFAOYSA-N
XLogP1.18
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl acetate;1-methyl-1-phenylhydrazine?
The IUPAC name of methyl acetate;1-methyl-1-phenylhydrazine (CID 90706381) is methyl acetate;1-methyl-1-phenylhydrazine.
What is the SMILES notation for methyl acetate;1-methyl-1-phenylhydrazine?
The canonical SMILES for methyl acetate;1-methyl-1-phenylhydrazine is CN(N)c1ccccc1.COC(C)=O.
What is the InChIKey of methyl acetate;1-methyl-1-phenylhydrazine?
The InChIKey is CHWMUUBPFHQWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.C3H6O2/c1-9(8)7-5-3-2-4-6-7;1-3(4)5-2/h2-6H,8H2,1H3;1-2H3.
What are the key properties of methyl acetate;1-methyl-1-phenylhydrazine?
methyl acetate;1-methyl-1-phenylhydrazine has a molecular weight of 196.25 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl acetate;1-methyl-1-phenylhydrazine is sourced from PubChem (CID 90706381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).