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Home Other Building Blocks Isopentyl pentyl phthalate

Isopentyl pentyl phthalate

CAS No.:
776297-69-9
Catalog Number:
AG0039XZ
Molecular Formula:
C18H26O4
Molecular Weight:
306.3966
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$99
- +
1g
95%
In Stock USA
United States
$249
- +
5g
95%
In Stock USA
United States
$749
- +
10g
95%
In Stock USA
United States
$1232
- +
Product Description
Catalog Number:
AG0039XZ
Chemical Name:
Isopentyl pentyl phthalate
CAS Number:
776297-69-9
Molecular Formula:
C18H26O4
Molecular Weight:
306.3966
MDL Number:
MFCD11114532
IUPAC Name:
2-O-(3-methylbutyl) 1-O-pentyl benzene-1,2-dicarboxylate
InChI:
InChI=1S/C18H26O4/c1-4-5-8-12-21-17(19)15-9-6-7-10-16(15)18(20)22-13-11-14(2)3/h6-7,9-10,14H,4-5,8,11-13H2,1-3H3
InChI Key:
MCXWUHMDAJQKBI-UHFFFAOYSA-N
SMILES:
CCCCCOC(=O)c1ccccc1C(=O)OCCC(C)C
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.183g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.402g/mol
Monoisotopic Mass:
306.183g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  
Properties