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141-19-5 | Decanedioic acid, 1,10-bis(2-butoxyethyl) ester
CAS No: 141-19-5 Catalog No: AG001FPR MDL No:
Product Description
Catalog Number:
AG001FPR
Chemical Name:
Decanedioic acid, 1,10-bis(2-butoxyethyl) ester
CAS Number:
141-19-5
Molecular Formula:
C22H42O6
Molecular Weight:
402.5653
IUPAC Name:
bis(2-butoxyethyl) decanedioate
InChI:
InChI=1S/C22H42O6/c1-3-5-15-25-17-19-27-21(23)13-11-9-7-8-10-12-14-22(24)28-20-18-26-16-6-4-2/h3-20H2,1-2H3
InChI Key:
KZBSIGKPGIZQJQ-UHFFFAOYSA-N
SMILES:
CCCCOCCOC(=O)CCCCCCCCC(=O)OCCOCCCC
EC Number:
205-467-6
UNII:
9D0TU0RR8Z
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.298g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.572g/mol
Monoisotopic Mass:
402.298g/mol
Rotatable Bond Count:
23
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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