ditert-butyl oxalate;hydrazine

C10H22N2O4 — CID 88669499

IUPACditert-butyl oxalate;hydrazine
SMILESCC(C)(C)OC(=O)C(=O)OC(C)(C)C.NN
InChIInChI=1S/C10H18O4.H4N2/c1-9(2,3)13-7(11)8(12)14-10(4,5)6;1-2/h1-6H3;1-2H2
InChIKeyVFWKWDCFWOBGSF-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.49
Rot. Bonds

About ditert-butyl oxalate;hydrazine

ditert-butyl oxalate;hydrazine (PubChem CID 88669499) has the molecular formula C10H22N2O4 and a molecular weight of 234.30 g/mol. Its IUPAC name is ditert-butyl oxalate;hydrazine.

Molecular Properties

Compound Nameditert-butyl oxalate;hydrazine
PubChem CID88669499
Molecular FormulaC10H22N2O4
Molecular Weight234.30 g/mol
Exact Mass234.16
IUPAC Nameditert-butyl oxalate;hydrazine
SMILESCC(C)(C)OC(=O)C(=O)OC(C)(C)C.NN
InChIInChI=1S/C10H18O4.H4N2/c1-9(2,3)13-7(11)8(12)14-10(4,5)6;1-2/h1-6H3;1-2H2
InChIKeyVFWKWDCFWOBGSF-UHFFFAOYSA-N
XLogP0.49
TPSA104.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-O-tert-butyl 2-O-chloro oxalate
CID 54089590
potassium 2-[(2-methylpropan-2-yl)oxy]-2-oxoacetate
CID 75527807
(Z)-2-methyl-1,3-bis[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-en-1-olate
CID 134894334
CID 171370380
CID 171370380
2-O-tert-butyl 1-O-(3-methylbutyl) oxalate
CID 56996689
tert-butyl (2E)-2-amino-2-chloroiminoacetate
CID 56652484
3-O-tert-butyl 1-O-methyl 2-oxopropanedioate
CID 140731736
tert-butyl 3-acetyloxy-2-oxopropanoate
CID 172764562
tert-butyl 5-amino-2-methylidenepentanoate;hydrofluoride
CID 88512877
tert-butyl 2-bromobut-2-enoate
CID 86092926
tert-butyl acetate
CID 159704758
tert-butyl hydrogen carbonate;2-methylpropan-2-amine
CID 173023605

Frequently Asked Questions

What is the IUPAC name of ditert-butyl oxalate;hydrazine?
The IUPAC name of ditert-butyl oxalate;hydrazine (CID 88669499) is ditert-butyl oxalate;hydrazine.
What is the SMILES notation for ditert-butyl oxalate;hydrazine?
The canonical SMILES for ditert-butyl oxalate;hydrazine is CC(C)(C)OC(=O)C(=O)OC(C)(C)C.NN.
What is the InChIKey of ditert-butyl oxalate;hydrazine?
The InChIKey is VFWKWDCFWOBGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4.H4N2/c1-9(2,3)13-7(11)8(12)14-10(4,5)6;1-2/h1-6H3;1-2H2.
What are the key properties of ditert-butyl oxalate;hydrazine?
ditert-butyl oxalate;hydrazine has a molecular weight of 234.30 g/mol, XLogP of 0.49, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ditert-butyl oxalate;hydrazine is sourced from PubChem (CID 88669499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).