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1443346-87-9 | 2-n-Butoxy-3,5-difluorobenzyl alcohol
CAS No: 1443346-87-9 Catalog No: AG01FD74 MDL No:
Product Description
Catalog Number:
AG01FD74
Chemical Name:
2-n-Butoxy-3,5-difluorobenzyl alcohol
CAS Number:
1443346-87-9
Molecular Formula:
C11H14F2O2
Molecular Weight:
216.2245
IUPAC Name:
(2-butoxy-3,5-difluorophenyl)methanol
InChI:
InChI=1S/C11H14F2O2/c1-2-3-4-15-11-8(7-14)5-9(12)6-10(11)13/h5-6,14H,2-4,7H2,1H3
InChI Key:
ZISXBNNABDIREX-UHFFFAOYSA-N
SMILES:
CCCCOc1c(F)cc(cc1CO)F
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.228g/mol
Monoisotopic Mass:
216.096g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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