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162103343 molecular structure
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bis(methane)

ChemBase ID: 3768
Molecular Formular: C2
Molecular Mass: 24.0214
Monoisotopic Mass: 24
SMILES and InChIs

SMILES:
C.C
Canonical SMILES:
C.C
InChI:
InChI=1S/2CH4/h2*1H4
InChIKey:
CREMABGTGYGIQB-UHFFFAOYSA-N

Cite this record

CBID:3768 http://www.chembase.cn/molecule-3768.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(methane)
IUPAC Traditional name
bis(flavan)
Synonyms
Terminal Dimethyl
PubChem SID
162103343
PubChem CID
444749

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) 1.080923  LogD (pH = 7.4) 1.080923 
Log P 1.080923  Molar Refractivity 6.3468 cm3
Polarizability 2.601 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

DrugBank DrugBank
DrugBank - DB04148 external link
Drug information: experimental

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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