Home > Compound List > Compound details
42596-56-5 molecular structure
click picture or here to close

6-aminopyridine-3-carbohydrazide

ChemBase ID: 39843
Molecular Formular: C6H8N4O
Molecular Mass: 152.15392
Monoisotopic Mass: 152.0698109
SMILES and InChIs

SMILES:
c1(C(=O)NN)cnc(cc1)N
Canonical SMILES:
NNC(=O)c1ccc(nc1)N
InChI:
InChI=1S/C6H8N4O/c7-5-2-1-4(3-9-5)6(11)10-8/h1-3H,8H2,(H2,7,9)(H,10,11)
InChIKey:
MUTYGKWOSMNYBG-UHFFFAOYSA-N

Cite this record

CBID:39843 http://www.chembase.cn/molecule-39843.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
6-aminopyridine-3-carbohydrazide
IUPAC Traditional name
6-aminopyridine-3-carbohydrazide
Synonyms
6-Aminonicotinohydrazide
CAS Number
42596-56-5
MDL Number
MFCD03844845
PubChem SID
161003150
PubChem CID
2763340

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 2763340 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 14.105808  H Acceptors
H Donor LogD (pH = 5.5) -0.9339067 
LogD (pH = 7.4) -0.9248471  Log P -0.9247304 
Molar Refractivity 42.4775 cm3 Polarizability 14.869762 Å3
Polar Surface Area 94.03 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
228 - 232 °C expand Show data source
228-232°C expand Show data source
Storage Warning
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
Purity
>95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle