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126163-37-9 | 2,3-Difluoro-4-pentylphenol
CAS No: 126163-37-9 Catalog No: AG01FFDK MDL No:
Product Description
Catalog Number:
AG01FFDK
Chemical Name:
2,3-Difluoro-4-pentylphenol
CAS Number:
126163-37-9
Molecular Formula:
C11H14F2O
Molecular Weight:
200.2251
IUPAC Name:
2,3-difluoro-4-pentylphenol
InChI:
InChI=1S/C11H14F2O/c1-2-3-4-5-8-6-7-9(14)11(13)10(8)12/h6-7,14H,2-5H2,1H3
InChI Key:
HLSNWDXIBLGPNV-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(c(c1F)F)O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.101g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.229g/mol
Monoisotopic Mass:
200.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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