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24631-68-3 | 2-Propanol, 1,3-bis(octyloxy)-
CAS No: 24631-68-3 Catalog No: AG002OVY MDL No:
Product Description
Catalog Number:
AG002OVY
Chemical Name:
2-Propanol, 1,3-bis(octyloxy)-
CAS Number:
24631-68-3
Molecular Formula:
C19H40O3
Molecular Weight:
316.5191
IUPAC Name:
1,3-dioctoxypropan-2-ol
InChI:
InChI=1S/C19H40O3/c1-3-5-7-9-11-13-15-21-17-19(20)18-22-16-14-12-10-8-6-4-2/h19-20H,3-18H2,1-2H3
InChI Key:
RBGYBTJRVDFANH-UHFFFAOYSA-N
SMILES:
CCCCCCCCOCC(COCCCCCCCC)O
UNII:
3AM9218OT0
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.298g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.526g/mol
Monoisotopic Mass:
316.298g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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