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MFCD00272257 molecular structure
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2-(dimethylamino)acetohydrazide

ChemBase ID: 269392
Molecular Formular: C4H11N3O
Molecular Mass: 117.14964
Monoisotopic Mass: 117.09021199
SMILES and InChIs

SMILES:
C(=O)(NN)CN(C)C
Canonical SMILES:
NNC(=O)CN(C)C
InChI:
InChI=1S/C4H11N3O/c1-7(2)3-4(8)6-5/h3,5H2,1-2H3,(H,6,8)
InChIKey:
DALNXMAZDJRTPB-UHFFFAOYSA-N

Cite this record

CBID:269392 http://www.chembase.cn/molecule-269392.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(dimethylamino)acetohydrazide
IUPAC Traditional name
2-(dimethylamino)acetohydrazide
Synonyms
2-(dimethylamino)acetohydrazide
MDL Number
MFCD00272257
PubChem SID
164325302
PubChem CID
68319

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Enamine
EN300-67052 external link Add to cart Please log in.
Data Source Data ID
PubChem 68319 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 13.113587  H Acceptors
H Donor LogD (pH = 5.5) -3.3483858 
LogD (pH = 7.4) -1.7458781  Log P -1.4352655 
Molar Refractivity 32.379 cm3 Polarizability 12.276264 Å3
Polar Surface Area 58.36 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Product Information Bioassay(PubChem)
Hydrophobicity(logP)
-1.271 expand Show data source
Purity
95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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