sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 2-Bromo-1,3-diethylbenzene

2-Bromo-1,3-diethylbenzene

CAS No.:
65232-57-7
Catalog Number:
AG003GLY
Molecular Formula:
C10H13Br
Molecular Weight:
213.1142
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
95%
In Stock USA
United States
$150
- +
10g
95%
In Stock USA
United States
$263
- +
25g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG003GLY
Chemical Name:
2-Bromo-1,3-diethylbenzene
CAS Number:
65232-57-7
Molecular Formula:
C10H13Br
Molecular Weight:
213.1142
MDL Number:
MFCD00017770
IUPAC Name:
2-bromo-1,3-diethylbenzene
InChI:
InChI=1S/C10H13Br/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7H,3-4H2,1-2H3
InChI Key:
FPWGIABDOFXETH-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1Br)CC
Properties
Complexity:
99.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.118g/mol
Monoisotopic Mass:
212.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
4D-QSAR analysis of a set of propofol analogues: mapping binding sites for an anesthetic phenol on the GABA(A) receptor. Journal of medicinal chemistry 20020718
Properties