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57499-93-1 | Tripropylene glycol mono-n-butyl ether
CAS No: 57499-93-1 Catalog No: AG003AQA MDL No:
Product Description
Catalog Number:
AG003AQA
Chemical Name:
Tripropylene glycol mono-n-butyl ether
CAS Number:
57499-93-1
Molecular Formula:
C13H28O4
Molecular Weight:
248.3590
IUPAC Name:
1-[1-(1-butoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
InChI:
InChI=1S/C13H28O4/c1-5-6-7-15-9-12(3)17-10-13(4)16-8-11(2)14/h11-14H,5-10H2,1-4H3
InChI Key:
LORVPHHKJFSORQ-UHFFFAOYSA-N
SMILES:
CCCCOCC(OCC(OCC(O)C)C)C
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.199g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.363g/mol
Monoisotopic Mass:
248.199g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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