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1443310-30-2 | 3-(3,5-Difluoro-4-n-propoxyphenyl)-1-propene
CAS No: 1443310-30-2 Catalog No: AG01FAOT MDL No:
Product Description
Catalog Number:
AG01FAOT
Chemical Name:
3-(3,5-Difluoro-4-n-propoxyphenyl)-1-propene
CAS Number:
1443310-30-2
Molecular Formula:
C12H14F2O
Molecular Weight:
212.2358
IUPAC Name:
1,3-difluoro-5-prop-2-enyl-2-propoxybenzene
InChI:
InChI=1S/C12H14F2O/c1-3-5-9-7-10(13)12(11(14)8-9)15-6-4-2/h3,7-8H,1,4-6H2,2H3
InChI Key:
VBPWGJSIPJZPBN-UHFFFAOYSA-N
SMILES:
CCCOc1c(F)cc(cc1F)CC=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:
212.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.24g/mol
Monoisotopic Mass:
212.101g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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