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14194-86-6 | Pentanal, 5-[(tetrahydro-2H-pyran-2-yl)oxy]-
CAS No: 14194-86-6 Catalog No: AG001HFC MDL No:
Product Description
Catalog Number:
AG001HFC
Chemical Name:
Pentanal, 5-[(tetrahydro-2H-pyran-2-yl)oxy]-
CAS Number:
14194-86-6
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
IUPAC Name:
5-(oxan-2-yloxy)pentanal
InChI:
InChI=1S/C10H18O3/c11-7-3-1-4-8-12-10-6-2-5-9-13-10/h7,10H,1-6,8-9H2
InChI Key:
CSMUJKWNNDUBDH-UHFFFAOYSA-N
SMILES:
O=CCCCCOC1CCCCO1
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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