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84027-84-9 | Oxazole, 5-pentyl-
CAS No: 84027-84-9 Catalog No: AG0051R4 MDL No:
Product Description
Catalog Number:
AG0051R4
Chemical Name:
Oxazole, 5-pentyl-
CAS Number:
84027-84-9
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
IUPAC Name:
5-pentyl-1,3-oxazole
InChI:
InChI=1S/C8H13NO/c1-2-3-4-5-8-6-9-7-10-8/h6-7H,2-5H2,1H3
InChI Key:
RZCKQDLMEGXPFA-UHFFFAOYSA-N
SMILES:
CCCCCc1cnco1
Properties
Complexity:
85.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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