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88404-79-9 | 2H-Pyran, 4-chloro-2,6-diethyltetrahydro-
CAS No: 88404-79-9 Catalog No: AG004IAD MDL No:
Product Description
Catalog Number:
AG004IAD
Chemical Name:
2H-Pyran, 4-chloro-2,6-diethyltetrahydro-
CAS Number:
88404-79-9
Molecular Formula:
C9H17ClO
Molecular Weight:
176.6837
IUPAC Name:
4-chloro-2,6-diethyloxane
InChI:
InChI=1S/C9H17ClO/c1-3-8-5-7(10)6-9(4-2)11-8/h7-9H,3-6H2,1-2H3
InChI Key:
UGASJEJNDSAOIM-UHFFFAOYSA-N
SMILES:
CCC1CC(Cl)CC(O1)CC
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.097g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.684g/mol
Monoisotopic Mass:
176.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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