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2122-48-7 molecular structure
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ethynyl

ChemBase ID: 130274
Molecular Formular: C2H
Molecular Mass: 25.02934
Monoisotopic Mass: 25.00782503
SMILES and InChIs

SMILES:
C#[C]
Canonical SMILES:
C#[C]
InChI:
InChI=1S/C2H/c1-2/h1H
InChIKey:
XEHVFKKSDRMODV-UHFFFAOYSA-N

Cite this record

CBID:130274 http://www.chembase.cn/molecule-130274.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
ethynyl
IUPAC Systematic name
Ethynyl
IUPAC Traditional name
ethynyl
Synonyms
Ethynyl radical
CAS Number
2122-48-7
Beilstein Number
1814004
PubChem SID
162224553
PubChem CID
123271
CHEBI ID
30085
Chemspider ID
109883
Gmelin ID
48916
Wikipedia Title
Ethynyl_radical

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.2114  LogD (pH = 7.4) 0.2114 
Log P 0.2114  Molar Refractivity 6.983 cm3
Polarizability 3.3829322 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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