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123-59-1 | Propane, 1-ethoxy-1,3,3-trimethoxy-
CAS No: 123-59-1 Catalog No: AG000JWZ MDL No:
Product Description
Catalog Number:
AG000JWZ
Chemical Name:
Propane, 1-ethoxy-1,3,3-trimethoxy-
CAS Number:
123-59-1
Molecular Formula:
C8H18O4
Molecular Weight:
178.2261
IUPAC Name:
1-ethoxy-1,3,3-trimethoxypropane
InChI:
InChI=1S/C8H18O4/c1-5-12-8(11-4)6-7(9-2)10-3/h7-8H,5-6H2,1-4H3
InChI Key:
GHZXJUYUMMBNHP-UHFFFAOYSA-N
SMILES:
CCOC(CC(OC)OC)OC
EC Number:
204-636-1
Properties
Complexity:
93.1
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:
0
Isotope Atom Count:
0
Molecular Weight:
178.228g/mol
Monoisotopic Mass:
178.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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