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88911-41-5 | Isoxazole, 5-(dimethoxymethyl)-4,5-dihydro-3-pentyl-
CAS No: 88911-41-5 Catalog No: AG008A5X MDL No:
Product Description
Catalog Number:
AG008A5X
Chemical Name:
Isoxazole, 5-(dimethoxymethyl)-4,5-dihydro-3-pentyl-
CAS Number:
88911-41-5
Molecular Formula:
C11H21NO3
Molecular Weight:
215.2893
IUPAC Name:
5-(dimethoxymethyl)-3-pentyl-4,5-dihydro-1,2-oxazole
InChI:
InChI=1S/C11H21NO3/c1-4-5-6-7-9-8-10(15-12-9)11(13-2)14-3/h10-11H,4-8H2,1-3H3
InChI Key:
IQKQMBWBDVVJPU-UHFFFAOYSA-N
SMILES:
CCCCCC1=NOC(C1)C(OC)OC
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.152g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.293g/mol
Monoisotopic Mass:
215.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
40A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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