Home > Compound List > Compound details
134459-04-4 molecular structure
click picture or here to close

(3-14C)fluoranthene

ChemBase ID: 131366
Molecular Formular: C16H10
Molecular Mass: 204.24314199
Monoisotopic Mass: 204.08149231
SMILES and InChIs

SMILES:
c1ccc2c(c1)c1cccc3c1c2cc[14cH]3
Canonical SMILES:
c1ccc2c(c1)c1cc[14cH]c3c1c2ccc3
InChI:
InChI=1S/C16H10/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-10H/i5+2
InChIKey:
GVEPBJHOBDJJJI-RHRFEJLCSA-N

Cite this record

CBID:131366 http://www.chembase.cn/molecule-131366.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(3-14C)fluoranthene
IUPAC Traditional name
(3-14C)fluoranthene
Synonyms
Fluoranthene-3-14C
CAS Number
134459-04-4
MDL Number
MFCD00133326
PubChem SID
24894903
162225644
PubChem CID
16219363

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
F6147 external link Add to cart Please log in.
Data Source Data ID
PubChem 16219363 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.2839274  LogD (pH = 7.4) 4.2839274 
Log P 4.2839274  Molar Refractivity 66.7226 cm3
Polarizability 30.029507 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
methanol solution expand Show data source
Mass Shift
M+2 expand Show data source
European Hazard Symbols
R expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
2910 expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
7 expand Show data source
Risk Statements
22 expand Show data source
RID/ADR
UN 2910 7 expand Show data source
Storage Temperature
2-8°C expand Show data source
Extent of Labeling
40-60 mCi per mmol expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - F6147 external link
包装
Sealed ampule

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