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101453-05-8 | Oxirane, 2-[[(2-butyloctyl)oxy]methyl]-
CAS No: 101453-05-8 Catalog No: AG0004HV MDL No:
Product Description
Catalog Number:
AG0004HV
Chemical Name:
Oxirane, 2-[[(2-butyloctyl)oxy]methyl]-
CAS Number:
101453-05-8
Molecular Formula:
C15H30O2
Molecular Weight:
242.3975
IUPAC Name:
2-(2-butyloctoxymethyl)oxirane
InChI:
InChI=1S/C15H30O2/c1-3-5-7-8-10-14(9-6-4-2)11-16-12-15-13-17-15/h14-15H,3-13H2,1-2H3
InChI Key:
IXORNPPEKYKHCI-UHFFFAOYSA-N
SMILES:
CCCCC(COCC1OC1)CCCCCC
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.225g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.403g/mol
Monoisotopic Mass:
242.225g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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