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88928-41-0 | Furan, 2-methyl-3-phenyl-5-propyl-
CAS No: 88928-41-0 Catalog No: AG0048VB MDL No:
Product Description
Catalog Number:
AG0048VB
Chemical Name:
Furan, 2-methyl-3-phenyl-5-propyl-
CAS Number:
88928-41-0
Molecular Formula:
C14H16O
Molecular Weight:
200.2762
IUPAC Name:
2-methyl-3-phenyl-5-propylfuran
InChI:
InChI=1S/C14H16O/c1-3-7-13-10-14(11(2)15-13)12-8-5-4-6-9-12/h4-6,8-10H,3,7H2,1-2H3
InChI Key:
ZBVRUYSZSAWETD-UHFFFAOYSA-N
SMILES:
CCCc1oc(c(c1)c1ccccc1)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.12g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.281g/mol
Monoisotopic Mass:
200.12g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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