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Home Other Building Blocks 2-ETHYLANTHRACENE

2-ETHYLANTHRACENE

CAS No.:
52251-71-5
Catalog Number:
AG00DAHL
Molecular Formula:
C16H14
Molecular Weight:
206.2824
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Product Description
Catalog Number:
AG00DAHL
Chemical Name:
2-ETHYLANTHRACENE
CAS Number:
52251-71-5
Molecular Formula:
C16H14
Molecular Weight:
206.2824
MDL Number:
MFCD00003584
IUPAC Name:
2-ethylanthracene
InChI:
InChI=1S/C16H14/c1-2-12-7-8-15-10-13-5-3-4-6-14(13)11-16(15)9-12/h3-11H,2H2,1H3
InChI Key:
ZXAGXLDEMUNQSH-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)cc1c(c2)cccc1
EC Number:
257-788-6
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.11g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.288g/mol
Monoisotopic Mass:
206.11g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Literature
Title Journal
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties