Home Other Building Blocks 1,3-Diisopropoxybenzene

1,3-Diisopropoxybenzene

CAS No.:
79128-08-8
Catalog Number:
AG003DK2
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
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Product Description
Catalog Number:
AG003DK2
Chemical Name:
1,3-Diisopropoxybenzene
CAS Number:
79128-08-8
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
MDL Number:
MFCD07784412
IUPAC Name:
1,3-di(propan-2-yloxy)benzene
InChI:
InChI=1S/C12H18O2/c1-9(2)13-11-6-5-7-12(8-11)14-10(3)4/h5-10H,1-4H3
InChI Key:
REKFSOLBSHAFDG-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1)OC(C)C)C
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties