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3-Ethyl-3-methyldiaziridine

HCID 78618
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
4901-75-1
Standard SMILES
CCC1(C)NN1
InChIKey
MLTKZVHOZAKJMV-UHFFFAOYSA-N
Molecular formula
C4H10N2
Average molar mass
86.14 g/mol
Monoisotopic mass
86.08439833

Names & identifiers

Preferred name
3-Ethyl-3-methyldiaziridine
IUPAC
3-ethyl-3-methyldiaziridine
English name
3-ethyl-3-methyl-diaziridine
Molecular formula
C4H10N2
Molecular weight
86.14

Names & synonyms

3-Ethyl-3-methyldiaziridineDiaziridine, 3-ethyl-3-methyl-GKG20GS2C4NSC 39492NSC-39492UNII-GKG20GS2C43-Methyl-3-ethyldiaziridine3-Methyl-3-ethyl-1,2-diazacyclopropaneAI3-52872c-C(CH3)(C2H5)NHNHDTXSID1063643RefChem:93829
Show more names
DTXCID1040663MLTKZVHOZAKJMV-UHFFFAOYSA-N4901-75-13-ethyl-3-methyl-diaziridineNSC39492SCHEMBL620750

Database identifiers

CAS
4901-75-1
PubChem CID
78618
DTXSID
DTXSID1063643
UNII
GKG20GS2C4
Nikkaji
J24.550J

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
43.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
6
Formal charge
0
Complexity
56.6

Physicochemical properties

Boiling point
32 °C · 32 °C(Press: 17 Torr)
Density
0.85 · 0.850±0.06 g/cm3(Predicted)
pka
6.84 · 6.84±0.40(Predicted)
FDA UNII
20 GS2C4 · GKG20GS2C4
EPA Substance Registry System
3 · Diaziridine, 3-ethyl-3-methyl- (4901-75-1)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationDiaziridine, 3-ethyl-3-methyl-: INACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes