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Home > Fluorides > 887585-14-0
887585-14-0 | 3,4-Difluoro-5-methoxybenzyl alcohol
CAS No: 887585-14-0 Catalog No: AG01EYI7 MDL No:
Product Description
Catalog Number:
AG01EYI7
Chemical Name:
3,4-Difluoro-5-methoxybenzyl alcohol
CAS Number:
887585-14-0
Molecular Formula:
C8H8F2O2
Molecular Weight:
174.1447
IUPAC Name:
(3,4-difluoro-5-methoxyphenyl)methanol
InChI:
InChI=1S/C8H8F2O2/c1-12-7-3-5(4-11)2-6(9)8(7)10/h2-3,11H,4H2,1H3
InChI Key:
JERMCFDXSJJJSJ-UHFFFAOYSA-N
SMILES:
COc1cc(CO)cc(c1F)F
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.049g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.147g/mol
Monoisotopic Mass:
174.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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