Home > Compound List > Compound details
557-21-1 molecular structure
click picture or here to close

zincdicarbonitrile

ChemBase ID: 148360
Molecular Formular: C2N2Zn
Molecular Mass: 117.4148
Monoisotopic Mass: 115.93529001
SMILES and InChIs

SMILES:
C(#N)[Zn]C#N
Canonical SMILES:
N#C[Zn]C#N
InChI:
InChI=1S/2CN.Zn/c2*1-2;
InChIKey:
VJHHEOJUJAQMPF-UHFFFAOYSA-N

Cite this record

CBID:148360 http://www.chembase.cn/molecule-148360.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
zincdicarbonitrile
IUPAC Traditional name
zinc cyanide
Synonyms
Zinc cyanide
氰化锌
CAS Number
557-21-1
EC Number
209-162-9
MDL Number
MFCD00011292
Beilstein Number
4124366
PubChem SID
24855530
162242536
PubChem CID
11186

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
256498 external link Add to cart Please log in.
Data Source Data ID
PubChem 11186 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.0642  LogD (pH = 7.4) -0.0642 
Log P -0.0642  Molar Refractivity 13.3112 cm3
Polarizability 7.725714 Å3 Polar Surface Area 47.58 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Density
1.85 g/mL at 25 °C(lit.) expand Show data source
RTECS
ZH1575000 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Highly toxic Highly toxic (T+) expand Show data source
UN Number
1713 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
1 expand Show data source
Risk Statements
26/27/28-32-50/53 expand Show data source
Safety Statements
7-28-29-45-60-61 expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H300-H310-H330-H410 expand Show data source
GHS Precautionary statements
P260-P264-P273-P280-P284-P301 + P310 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 1713 6.1/PG 1 expand Show data source
Supplemental Hazard Statements
Contact with acids liberates very toxic gas. expand Show data source
Purity
98% expand Show data source
Linear Formula
Zn(CN)2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 256498 external link
Packaging
1 kg in glass bottle
5, 250 g in glass bottle

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