200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 101887-40-5
101887-40-5 | Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis-, dimethyl ester (9CI)
CAS No: 101887-40-5 Catalog No: AG0005UL MDL No:
Product Description
Catalog Number:
AG0005UL
Chemical Name:
Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis-, dimethyl ester (9CI)
CAS Number:
101887-40-5
Molecular Formula:
C18H26O6
Molecular Weight:
338.3954
IUPAC Name:
methyl 5-[4-(5-methoxy-5-oxopentoxy)phenoxy]pentanoate
InChI:
InChI=1S/C18H26O6/c1-21-17(19)7-3-5-13-23-15-9-11-16(12-10-15)24-14-6-4-8-18(20)22-2/h9-12H,3-8,13-14H2,1-2H3
InChI Key:
JZUOYBAJTOHMEX-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCOc1ccc(cc1)OCCCCC(=O)OC
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.173g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.4g/mol
Monoisotopic Mass:
338.173g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.