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56106-37-7 | 1,3-Dipropoxybenzene
CAS No: 56106-37-7 Catalog No: AG003DKP MDL No:MFCD00059402
Product Description
Catalog Number:
AG003DKP
Chemical Name:
1,3-Dipropoxybenzene
CAS Number:
56106-37-7
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
MDL Number:
MFCD00059402
IUPAC Name:
1,3-dipropoxybenzene
InChI:
InChI=1S/C12H18O2/c1-3-8-13-11-6-5-7-12(10-11)14-9-4-2/h5-7,10H,3-4,8-9H2,1-2H3
InChI Key:
UTFRNSPYRPYKDV-UHFFFAOYSA-N
SMILES:
CCCOc1cccc(c1)OCCC
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Screening of dialkoxybenzenes and disubstituted cyclopentene derivatives against the cabbage looper, Trichoplusia ni, for the discovery of new feeding and oviposition deterrents. | Journal of agricultural and food chemistry 20071212 |
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