Home Other Building Blocks Ethyl isobutyl phthalate

Ethyl isobutyl phthalate

CAS No.:
94491-96-0
Catalog Number:
AG003DBT
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$28
- +
5g
95%
In Stock USA
United States
$875
- +
Product Description
Catalog Number:
AG003DBT
Chemical Name:
Ethyl isobutyl phthalate
CAS Number:
94491-96-0
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
MDL Number:
MFCD28053434
IUPAC Name:
1-O-ethyl 2-O-(2-methylpropyl) benzene-1,2-dicarboxylate
InChI:
InChI=1S/C14H18O4/c1-4-17-13(15)11-7-5-6-8-12(11)14(16)18-9-10(2)3/h5-8,10H,4,9H2,1-3H3
InChI Key:
POXXQVSKWJPZNO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1C(=O)OCC(C)C
Properties
Complexity:
286  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties