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100688-48-0 | 1-Propanol, 3-[2-(2-methoxyethoxy)ethoxy]-
CAS No: 100688-48-0 Catalog No: AG0002N2 MDL No:MFCD26841942
Product Description
Catalog Number:
AG0002N2
Chemical Name:
1-Propanol, 3-[2-(2-methoxyethoxy)ethoxy]-
CAS Number:
100688-48-0
Molecular Formula:
C8H18O4
Molecular Weight:
178.2261
MDL Number:
MFCD26841942
IUPAC Name:
3-[2-(2-methoxyethoxy)ethoxy]propan-1-ol
InChI:
InChI=1S/C8H18O4/c1-10-5-6-12-8-7-11-4-2-3-9/h9H,2-8H2,1H3
InChI Key:
QBHPYEIJQRUYLB-UHFFFAOYSA-N
SMILES:
OCCCOCCOCCOC
Properties
Complexity:
77.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.121g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.228g/mol
Monoisotopic Mass:
178.121g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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