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1443355-00-7

1443355-00-7 | 3-(3-n-Butoxy-4,5-difluorophenyl)-1-propene

CAS No: 1443355-00-7 Catalog No: AG01FB25 MDL No:

Product Description

Catalog Number:
AG01FB25
Chemical Name:
3-(3-n-Butoxy-4,5-difluorophenyl)-1-propene
CAS Number:
1443355-00-7
Molecular Formula:
C13H16F2O
Molecular Weight:
226.2623
IUPAC Name:
1-butoxy-2,3-difluoro-5-prop-2-enylbenzene
InChI:
InChI=1S/C13H16F2O/c1-3-5-7-16-12-9-10(6-4-2)8-11(14)13(12)15/h4,8-9H,2-3,5-7H2,1H3
InChI Key:
DPARXNFUSKKUSF-UHFFFAOYSA-N
SMILES:
CCCCOc1cc(CC=C)cc(c1F)F

Properties

Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.117g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.267g/mol
Monoisotopic Mass:
226.117g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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