1,1-Diethylhydrazine
PubChem CID
69222
Structure
Molecular Formula
Synonyms
- 1,1-Diethylhydrazine
- 616-40-0
- Diethylhydrazine
- N,N-Diethylhydrazine
- Hydrazine, 1,1-diethyl-
Molecular Weight
88.15 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-03-27
- Modify:2025-02-01
Chemical Structure Depiction
1,1-diethylhydrazine
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C4H12N2/c1-3-6(5)4-2/h3-5H2,1-2H3
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
IFZHGQSUNAKKSN-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
CCN(CC)N
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C4H12N2
Computed by PubChem 2.2 (PubChem release 2021.10.14)
- 1,1-Diethylhydrazine
- 616-40-0
- Diethylhydrazine
- N,N-Diethylhydrazine
- Hydrazine, 1,1-diethyl-
- Hydrazine, diethyl-
- CCRIS 4556
- AI3-26686
- 40626-95-7
- 1,1-diethyldiazane
- N,N-diethyl-hydrazine
- N,N-Diethylhydrazine;
- Hydrazine,1,1-diethyl-
- hydrazine, N,N-diethyl-
- DTXSID00870700
- MFCD02752099
- STL355871
- AKOS000271029
- A810276
- Q63408830
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
88.15 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3-AA
Property Value
0.3
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
1
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
2
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
88.100048391 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
88.100048391 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
29.3 Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
6
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
24.7
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
Standard non-polar
687
MoNA ID
MS Category
Experimental
MS Type
GC-MS
MS Level
MS1
Instrument
SHIMADZU LKB-2091
Instrument Type
EI-B
Ionization Mode
positive
Top 5 Peaks
73 99.99
88 48.80
45 46.30
42 22.50
28 17.50
License
CC BY-NC-SA
NIST Number
64426
Library
Main library
Total Peaks
27
m/z Top Peak
73
m/z 2nd Highest
88
m/z 3rd Highest
45
Thumbnail
Accession ID
Authors
SASAKI S, TOYOHASHI UNIV. OF TECH.
Instrument
SHIMADZU LKB-2091
Instrument Type
EI-B
MS Level
MS
Ionization Mode
POSITIVE
Ionization
ENERGY 70 eV
Top 5 Peaks
73 999
88 488
45 463
42 225
28 175
License
CC BY-NC-SA
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
PubMed Count
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=IFZHGQSUNAKKSN-UHFFFAOYSA-N
- CAS Common ChemistryLICENSEThe data from CAS Common Chemistry is provided under a CC-BY-NC 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc/4.0/1,1-Diethylhydrazinehttps://commonchemistry.cas.org/detail?cas_rn=616-40-0Hydrazine, diethyl-https://commonchemistry.cas.org/detail?cas_rn=40626-95-7
- ChemIDplusHydrazine, 1,1-diethyl-https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0000616400Hydrazine, diethyl-https://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0040626957ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- EPA DSSTox1,1-Diethylhydrazinehttps://comptox.epa.gov/dashboard/DTXSID00870700CompTox Chemicals Dashboard Chemical Listshttps://comptox.epa.gov/dashboard/chemical-lists/
- IUPAC Digitized pKa Datasethydrazine, N,N-diethyl-https://github.com/IUPAC/Dissociation-Constants
- Japan Chemical Substance Dictionary (Nikkaji)
- MassBank Europe1,1-DIETHYLHYDRAZINEhttps://massbank.eu/MassBank/Result.jsp?inchikey=IFZHGQSUNAKKSN-UHFFFAOYSA-N
- MassBank of North America (MoNA)LICENSEThe content of the MoNA database is licensed under CC BY 4.0.https://mona.fiehnlab.ucdavis.edu/documentation/license
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-lawHydrazine, 1,1-diethyl-http://www.nist.gov/srd/nist1a.cfm
- SpectraBaseHydrazine, 1,1-diethyl-https://spectrabase.com/spectrum/KGoaYj1nzG1,1-Diethylhydrazinehttps://spectrabase.com/spectrum/6HA60MKXWD3
- Springer Nature
- SpringerMaterialsN,N-diethyl-hydrazinehttps://materials.springer.com/substanceprofile/docs/smsid_fduesurvvlkwnguq
- Thieme ChemistryLICENSEThe Thieme Chemistry contribution within PubChem is provided under a CC-BY-NC-ND 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc-nd/4.0/
- Wikidata1,1-diethylhydrazinehttps://www.wikidata.org/wiki/Q63408830
- Wiley
- PubChem
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 388328271https://pubchem.ncbi.nlm.nih.gov/substance/388328271
CONTENTS