4-trimethylsilylbutanehydrazide;trihydrate

C7H24N2O4Si — CID 162097019

IUPAC4-trimethylsilylbutanehydrazide;trihydrate
SMILESC[Si](C)(C)CCCC(=O)NN.O.O.O
InChIInChI=1S/C7H18N2OSi.3H2O/c1-11(2,3)6-4-5-7(10)9-8;;;/h4-6,8H2,1-3H3,(H,9,10);3*1H2
InChIKeyJTUZMKGABPGXBH-UHFFFAOYSA-N
MW228.36 g/mol
LogP-1.38
Rot. Bonds4

About 4-trimethylsilylbutanehydrazide;trihydrate

4-trimethylsilylbutanehydrazide;trihydrate (PubChem CID 162097019) has the molecular formula C7H24N2O4Si and a molecular weight of 228.36 g/mol. Its IUPAC name is 4-trimethylsilylbutanehydrazide;trihydrate.

Molecular Properties

Compound Name4-trimethylsilylbutanehydrazide;trihydrate
PubChem CID162097019
Molecular FormulaC7H24N2O4Si
Molecular Weight228.36 g/mol
Exact Mass228.15
IUPAC Name4-trimethylsilylbutanehydrazide;trihydrate
SMILESC[Si](C)(C)CCCC(=O)NN.O.O.O
InChIInChI=1S/C7H18N2OSi.3H2O/c1-11(2,3)6-4-5-7(10)9-8;;;/h4-6,8H2,1-3H3,(H,9,10);3*1H2
InChIKeyJTUZMKGABPGXBH-UHFFFAOYSA-N
XLogP-1.38
TPSA149.62 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-trimethoxysilylbutanehydrazide
CID 12002198
hexanedihydrazide;pentanedihydrazide
CID 157195533
5-oxohexanehydrazide
CID 126993835
butanedihydrazide;hydrochloride
CID 54607274
3-trimethylstannylpropanehydrazide
CID 12901376
12-hydroxydodecanehydrazide
CID 12718243
10-hydrazinyl-10-oxodecanoic acid
CID 175271493
acetaldehyde;N-[(E)-ethylideneamino]-6-hydrazinyl-6-oxohexanamide;hexanedihydrazide;phosphane
CID 172937135
5-oxo-N-(3-trimethylsilylpropyl)pentanamide
CID 18730827
(E)-2-(3-trimethylsilylpropyl)but-2-enedioic acid
CID 87533904
4-ethylsulfanylbutanehydrazide
CID 63581929
9-trimethylsilylnon-1-en-3-one
CID 172735839

Frequently Asked Questions

What is the IUPAC name of 4-trimethylsilylbutanehydrazide;trihydrate?
The IUPAC name of 4-trimethylsilylbutanehydrazide;trihydrate (CID 162097019) is 4-trimethylsilylbutanehydrazide;trihydrate.
What is the SMILES notation for 4-trimethylsilylbutanehydrazide;trihydrate?
The canonical SMILES for 4-trimethylsilylbutanehydrazide;trihydrate is C[Si](C)(C)CCCC(=O)NN.O.O.O.
What is the InChIKey of 4-trimethylsilylbutanehydrazide;trihydrate?
The InChIKey is JTUZMKGABPGXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2OSi.3H2O/c1-11(2,3)6-4-5-7(10)9-8;;;/h4-6,8H2,1-3H3,(H,9,10);3*1H2.
What are the key properties of 4-trimethylsilylbutanehydrazide;trihydrate?
4-trimethylsilylbutanehydrazide;trihydrate has a molecular weight of 228.36 g/mol, XLogP of -1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-trimethylsilylbutanehydrazide;trihydrate is sourced from PubChem (CID 162097019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).